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Details

Stereochemistry MIXED
Molecular Formula C21H25ClO4
Molecular Weight 376.874
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BISPHENOL A (3-CHLORO-2-HYDROXYPROPYL)GLYCIDYL ETHER

SMILES

CC(C)(C1=CC=C(OCC(O)CCl)C=C1)C2=CC=C(OCC3CO3)C=C2

InChI

InChIKey=HLLOKZYCSSQYEB-UHFFFAOYSA-N
InChI=1S/C21H25ClO4/c1-21(2,15-3-7-18(8-4-15)24-12-17(23)11-22)16-5-9-19(10-6-16)25-13-20-14-26-20/h3-10,17,20,23H,11-14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C21H25ClO4
Molecular Weight 376.874
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:02:38 GMT 2023
Edited
by admin
on Sat Dec 16 09:02:38 GMT 2023
Record UNII
7W5KTO0C7S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BISPHENOL A (3-CHLORO-2-HYDROXYPROPYL)GLYCIDYL ETHER
Systematic Name English
2-PROPANOL, 1-CHLORO-3-(4-(1-METHYL-1-(4-(2-OXIRANYLMETHOXY)PHENYL)ETHYL)PHENOXY)-
Systematic Name English
BISPHENOL A 3-CHLORO-2-HYDROXYPROPYL GLYCIDYL ETHER
Systematic Name English
1-CHLORO-3-(4-(1-METHYL-1-(4-(2-OXIRANYLMETHOXY)PHENYL)ETHYL)PHENOXY)-2-PROPANOL
Systematic Name English
Code System Code Type Description
PUBCHEM
4169196
Created by admin on Sat Dec 16 09:02:38 GMT 2023 , Edited by admin on Sat Dec 16 09:02:38 GMT 2023
PRIMARY
CAS
13836-48-1
Created by admin on Sat Dec 16 09:02:38 GMT 2023 , Edited by admin on Sat Dec 16 09:02:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID30400216
Created by admin on Sat Dec 16 09:02:38 GMT 2023 , Edited by admin on Sat Dec 16 09:02:38 GMT 2023
PRIMARY
FDA UNII
7W5KTO0C7S
Created by admin on Sat Dec 16 09:02:38 GMT 2023 , Edited by admin on Sat Dec 16 09:02:38 GMT 2023
PRIMARY