2-Chloro-4-isocyanato-1-(1-methylethyl)benzene

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H10ClNO
Molecular Weight	195.646
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 2-Chloro-4-isocyanato-1-(1-methylethyl)benzene

Structure Search

SMILES

CC(C)C1=C(Cl)C=C(C=C1)N=C=O

InChI

InChIKey=ATVMYSGNLDWVSC-UHFFFAOYSA-N

InChI=1S/C10H10ClNO/c1-7(2)9-4-3-8(12-6-13)5-10(9)11/h3-5,7H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C10H10ClNO
Molecular Weight	195.646
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:27:59 GMT 2025` Edited by `admin` on `Tue Apr 01 20:27:59 GMT 2025`
Record UNII	97WZ4C2H5F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzene, 2-chloro-4-isocyanato-1-(1-methylethyl)-

Preferred Name

English

2-Chloro-4-isocyanato-1-(1-methylethyl)benzene

Systematic Name

English

Code System Code Type Description

CAS

34123-50-7

Created by admin on Tue Apr 01 20:27:59 GMT 2025 , Edited by admin on Tue Apr 01 20:27:59 GMT 2025

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FDA UNII

97WZ4C2H5F

Created by admin on Tue Apr 01 20:27:59 GMT 2025 , Edited by admin on Tue Apr 01 20:27:59 GMT 2025

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EPA CompTox

DTXSID90187713

Created by admin on Tue Apr 01 20:27:59 GMT 2025 , Edited by admin on Tue Apr 01 20:27:59 GMT 2025

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ECHA (EC/EINECS)

251-834-9

Created by admin on Tue Apr 01 20:27:59 GMT 2025 , Edited by admin on Tue Apr 01 20:27:59 GMT 2025

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PUBCHEM

118601

Created by admin on Tue Apr 01 20:27:59 GMT 2025 , Edited by admin on Tue Apr 01 20:27:59 GMT 2025

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