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Details

Stereochemistry ACHIRAL
Molecular Formula C11H13ClN2O3
Molecular Weight 256.686
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl (2-((2-chloroethyl)aminocarbonyl)phenyl)carbamate

SMILES

COC(=O)NC1=CC=CC=C1C(=O)NCCCl

InChI

InChIKey=JWVQGOOQLBZENQ-UHFFFAOYSA-N
InChI=1S/C11H13ClN2O3/c1-17-11(16)14-9-5-3-2-4-8(9)10(15)13-7-6-12/h2-5H,6-7H2,1H3,(H,13,15)(H,14,16)

HIDE SMILES / InChI

Molecular Formula C11H13ClN2O3
Molecular Weight 256.686
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:16:36 GMT 2025
Edited
by admin
on Tue Apr 01 20:16:36 GMT 2025
Record UNII
VJ5XT2GY3S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Carbamic acid, [2-[[(2-chloroethyl)amino]carbonyl]phenyl]-, methyl ester
Preferred Name English
Methyl (2-((2-chloroethyl)aminocarbonyl)phenyl)carbamate
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
285-425-1
Created by admin on Tue Apr 01 20:16:36 GMT 2025 , Edited by admin on Tue Apr 01 20:16:36 GMT 2025
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CAS
85098-73-3
Created by admin on Tue Apr 01 20:16:36 GMT 2025 , Edited by admin on Tue Apr 01 20:16:36 GMT 2025
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FDA UNII
VJ5XT2GY3S
Created by admin on Tue Apr 01 20:16:36 GMT 2025 , Edited by admin on Tue Apr 01 20:16:36 GMT 2025
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EPA CompTox
DTXSID50234196
Created by admin on Tue Apr 01 20:16:36 GMT 2025 , Edited by admin on Tue Apr 01 20:16:36 GMT 2025
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PUBCHEM
3020335
Created by admin on Tue Apr 01 20:16:36 GMT 2025 , Edited by admin on Tue Apr 01 20:16:36 GMT 2025
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