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Details

Stereochemistry ACHIRAL
Molecular Formula C14H19Cl2NO2
Molecular Weight 304.212
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-(BIS(2-CHLOROETHYL)AMINO)PHENETHYL ACETATE

SMILES

CC(=O)OCCC1=CC=C(C=C1)N(CCCl)CCCl

InChI

InChIKey=QEADDMRPIXYSTF-UHFFFAOYSA-N
InChI=1S/C14H19Cl2NO2/c1-12(18)19-11-6-13-2-4-14(5-3-13)17(9-7-15)10-8-16/h2-5H,6-11H2,1H3

HIDE SMILES / InChI

Molecular Formula C14H19Cl2NO2
Molecular Weight 304.212
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 19:37:07 GMT 2025
Edited
by admin
on Tue Apr 01 19:37:07 GMT 2025
Record UNII
GH039FBO6T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-116785
Preferred Name English
P-(BIS(2-CHLOROETHYL)AMINO)PHENETHYL ACETATE
Common Name English
BENZENEETHANOL, 4-(BIS(2-CHLOROETHYL)AMINO)-, ACETATE (ESTER)
Systematic Name English
PHENESTER
Common Name English
PHENETHYL ALCOHOL, P-(BIS(2-CHLOROETHYL)AMINO)-, ACETATE (ESTER)
Systematic Name English
BENZENEETHANOL, 4-(BIS(2-CHLOROETHYL)AMINO)-, 1-ACETATE
Systematic Name English
Code System Code Type Description
NSC
116785
Created by admin on Tue Apr 01 19:37:07 GMT 2025 , Edited by admin on Tue Apr 01 19:37:07 GMT 2025
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PUBCHEM
198083
Created by admin on Tue Apr 01 19:37:07 GMT 2025 , Edited by admin on Tue Apr 01 19:37:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID60183641
Created by admin on Tue Apr 01 19:37:07 GMT 2025 , Edited by admin on Tue Apr 01 19:37:07 GMT 2025
PRIMARY
CAS
29427-51-8
Created by admin on Tue Apr 01 19:37:07 GMT 2025 , Edited by admin on Tue Apr 01 19:37:07 GMT 2025
PRIMARY
FDA UNII
GH039FBO6T
Created by admin on Tue Apr 01 19:37:07 GMT 2025 , Edited by admin on Tue Apr 01 19:37:07 GMT 2025
PRIMARY