(3s)-3-Amino-3-(3-methylphenyl)propan-1-ol , CAS No.1212834-96-2

CAS: 1212834-96-2 Cat. No.: S1285608 Peso molecular: 165.236 PubChem CID: 25419092
Disponible para pedir
Storage
Room temperature
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Size
Estado
Price
Qty
250mg
S1285608-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
209,90US$
1g
S1285608-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
468,90US$
5g
S1285608-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.328,90US$
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

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

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores
Sonrisas canónicasCC1=CC(=CC=C1)C(CCO)N
IUPAC Name(3S)-3-amino-3-(3-methylphenyl)propan-1-ol
InChIKeyQBUYRBXUFMJAEP-JTQLQIEISA-N
INCHI1S/C10H15NO/c1-8-3-2-4-9(7-8)10(11)5-6-12/h2-4,7,10,12H,5-6,11H2,1H3/t10-/m0/s1
Isómeros SMILES CC1=CC(=CC=C1)[C@H](CCO)N
PubChem CID 25419092
Peso molecular 165.236

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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassToluenes
Intermediate Tree Nodes Not available
Direct ParentToluenes
Alternative Parents Aralkylamines  1,3-aminoalcohols  Primary alcohols  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aralkylamine - Toluene - 1,3-aminoalcohol - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Alcohol - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular165.230 g/mol
XLogP30.900
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass165.115 Da
Monoisotopic Mass165.115 Da
Topological Polar Surface Area46.300 Ų
Heavy Atom Count12
Formal Charge0
Complexity127.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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