3-Chlorophenyl isocyanate - ≥98% , CAS No.2909-38-8

CAS: 2909-38-8 Cat. No.: C107899 분자식: C7H4ClNO 분자량: 153.57 Beilstein Registry Number: 742445 EC 번호: 220-822-5
주문 가능
GRADE & PURITY ≥98%
Synonyms
3-chloro-1-isocyanato benzene | AKOS000119286 | 3-chloro-1-isocyanato-benzene | NSC76588 | NSC-76588 | E78077 | m-Chlorfenylisokyanat [Czech] | 3-Chlorophenylisocyanate | WLN: OCNR CG | BP-12958 | Isocyanic Acid 3-Chlorophenyl Ester | SCHEMBL58110 | EC 22
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
5g
C107899-5g
3 재고 있음
—
US$14.90
25g
C107899-25g
2 재고 있음
—
US$26.90
100g
C107899-100g
주문제작 · 8~12주
US$55.90
500g
C107899-500g
주문제작 · 8~12주
US$233.90
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
3-chloro-1-isocyanato benzene | AKOS000119286 | 3-chloro-1-isocyanato-benzene | NSC76588 | NSC-76588 | E78077 | m-Chlorfenylisokyanat [Czech] | 3-Chlorophenylisocyanate | WLN: OCNR CG | BP-12958 | Isocyanic Acid 3-Chlorophenyl Ester | SCHEMBL58110 | EC 22
사양 및 순도
≥98%
보관 조건
Store at 2-8°C,Argon charged
배송
Wet ice
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
순수함
≥98%
이름과 식별자
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504752856
정식 스마일
C1=CC(=CC(=C1)Cl)N=C=O
IUPAC Name
1-chloro-3-isocyanatobenzene
InChIKey
HHIRBXHEYVDUAM-UHFFFAOYSA-N
INCHI
1S/C7H4ClNO/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
이성체 SMILES
C1=CC(=CC(=C1)Cl)N=C=O
WGK 독일
2
RTECS
NQ8560000
UN 번호
2206
분자량
153.57
Beilstein
742445
Reaxy-Rn
742445
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742445&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
분류Benzene and substituted derivatives
SubclassHalobenzenes
Intermediate Tree Nodes Not available
Direct ParentChlorobenzenes
Alternative Parents Aryl chlorides  Isocyanates  Propargyl-type 1,3-dipolar organic compounds  Organopnictogen compounds  Organooxygen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Chlorobenzene - Aryl chloride - Aryl halide - Isocyanate - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
설명This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





인증서(CoA, COO, BSE/TSE 및 분석 차트)
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.

12 results found

Lot NumberCertificate Type날짜항목
I2518090Certificate of AnalysisSep 28, 2025 C107899
I2524172Certificate of AnalysisSep 28, 2025 C107899
I2524247Certificate of AnalysisSep 28, 2025 C107899
I2524248Certificate of AnalysisSep 28, 2025 C107899
I2524249Certificate of AnalysisSep 28, 2025 C107899
I2118044Certificate of AnalysisJul 12, 2024 C107899
I2118045Certificate of AnalysisJul 12, 2024 C107899
D2425250Certificate of AnalysisMar 21, 2024 C107899
K2201151Certificate of AnalysisOct 17, 2022 C107899
K2201152Certificate of AnalysisOct 17, 2022 C107899
K2201153Certificate of AnalysisOct 17, 2022 C107899
K2201154Certificate of AnalysisOct 17, 2022 C107899
화학 및 물리적 특성
감도Moisture Sensitive,Heat Sensitive
굴절률1.559
발화점(°F)179.6 °F
발화점(°C)82 °C
끓는점(°C)113-114°C
녹는점(°C)-4°C
분자량153.560 g/mol
XLogP33.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass152.998 Da
Monoisotopic Mass152.998 Da
Topological Polar Surface Area29.400 Ų
Heavy Atom Count10
Formal Charge0
Complexity154.000
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
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