3-Phenylpropionaldehyde - ≥95% , CAS No.104-53-0

CAS: 104-53-0 Cat. No.: P109695 Formula: C9H10O Molecular Weight: 134.18 Beilstein Registry Number: 1071910 EC Number: 203-211-8
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
AI3-01377 | NCGC00256683-01 | hydrocinnamaidehyde | BP-11455 | 3-Phenylpropan-1-al | Hydrocinnamic aldehyde | Phenylpropionaldehyde | AKOS000120255 | NSC9271 | NSC-9271 | P0217 | Benzenepropanal, 9CI | beta -phenylpropionaldehyde | Propionaidehyde, 3-phen
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
★
Size
USA
Germany (EU)*
Price
Qty
5g
P109695-5g
2 In stock
—

$9.90

$14.90
Save $5.00 (33.56%)
25g
P109695-25g
Made to order · 8–12 wks

$17.90

$26.90
Save $9.00 (33.46%)
100g
P109695-100g
2 In stock
—

$70.90

$106.90
Save $36.00 (33.68%)
500g
P109695-500g
Made to order · 8–12 wks

$196.90

$295.90
Save $99.00 (33.46%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 17 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Hydrocinnamaldehyde is C=C double bond hydrogenated cinnamaldehyde. It has been synthesized by the selective hydrogenation of C=C double bond of cinnamaldehyde by various methods. Hydrocinnamaldehyde and nitromethane undergoes Henry reaction to form nitroaldols . The C1 and C3 position labelled with 13C of hydrocinnamaldehyde was subjected to mass spectrometry and the fragmentation pattern was elucidated.

Specifications

Synonyms
AI3-01377 | NCGC00256683-01 | hydrocinnamaidehyde | BP-11455 | 3-Phenylpropan-1-al | Hydrocinnamic aldehyde | Phenylpropionaldehyde | AKOS000120255 | NSC9271 | NSC-9271 | P0217 | Benzenepropanal, 9CI | beta -phenylpropionaldehyde | Propionaidehyde, 3-phen
Specifications & Purity
≥95%
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%
Names and Identifiers
Pubchem Sid
Canonical Smiles
C1=CC=C(C=C1)CCC=O
IUPAC Name
3-phenylpropanal
InChIKey
YGCZTXZTJXYWCO-UHFFFAOYSA-N
INCHI
1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2
Isomeric SMILES
C1=CC=C(C=C1)CCC=O
WGK Germany
2
RTECS
MW4890000
Molecular Weight
134.18
Beilstein
1071910
Reaxy-Rn
1071910
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1071910&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzene and substituted derivatives
Alternative Parents Alpha-hydrogen aldehydes  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Monocyclic benzene moiety - Alpha-hydrogen aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Pseudomonas aeruginosa (123386 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Burkholderia cepacia (649 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Enterobacter cloacae (7976 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Klebsiella pneumoniae (43867 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Micrococcus luteus (7463 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Staphylococcus aureus (210822 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Escherichia coli (133304 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Aspergillus niger (16508 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Bacillus subtilis (32866 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Pichia kudriavzevii (7448 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Candida albicans (78123 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Trichophyton rubrum (3646 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Aspergillus parasiticus (296 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

20 results found

Lot NumberCertificate TypeDateItem
H2106206Certificate of AnalysisOct 09, 2026 P109695
A2607096Certificate of AnalysisJan 16, 2026 P109695
H2604070Certificate of AnalysisJan 16, 2026 P109695
B2507191Certificate of AnalysisFeb 11, 2025 P109695
K2513048Certificate of AnalysisFeb 11, 2025 P109695
H2106205Certificate of AnalysisFeb 07, 2025 P109695
H2106207Certificate of AnalysisFeb 07, 2025 P109695
G2417038Certificate of AnalysisJul 23, 2024 P109695
G2509054Certificate of AnalysisJul 23, 2024 P109695
G2417415Certificate of AnalysisApr 11, 2024 P109695
G2417416Certificate of AnalysisApr 11, 2024 P109695
G2417417Certificate of AnalysisApr 11, 2024 P109695
G2417418Certificate of AnalysisApr 11, 2024 P109695
G2412238Certificate of AnalysisApr 11, 2024 P109695
C2228129Certificate of AnalysisMar 08, 2022 P109695
C2228162Certificate of AnalysisMar 08, 2022 P109695
C2228128Certificate of AnalysisMar 08, 2022 P109695
C2228111Certificate of AnalysisMar 08, 2022 P109695
J2310177Certificate of AnalysisMar 08, 2022 P109695
C2228043Certificate of AnalysisMar 08, 2022 P109695
Chemical and Physical Properties
SolubilityMiscible with chloroform, dichloromethane, ethyl acetate, alcohol and ether. Immiscible with water.
SensitivityAir Sensitive;;Heat sensitive;
Refractive Index1.52-1.525
Flash Point(°F) 95℃
Flash Point(°C) 95℃
Boil Point(°C)224-226°C
Melt Point(°C)-42°C
Molecular Weight134.170 g/mol
XLogP31.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass134.073 Da
Monoisotopic Mass134.073 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count10
Formal Charge0
Complexity92.900
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Documents & Articles
Citations of This Product
Solution Calculators
Reviews

Customer Reviews

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