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Details

Stereochemistry ACHIRAL
Molecular Formula C7H9ClO4
Molecular Weight 192.597
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-CHLOROALLYLIDENE-3,3-DIACETATE

SMILES

CC(=O)OC(OC(C)=O)C(Cl)=C

InChI

InChIKey=PPHOKWJFQIHKNR-UHFFFAOYSA-N
InChI=1S/C7H9ClO4/c1-4(8)7(11-5(2)9)12-6(3)10/h7H,1H2,2-3H3

HIDE SMILES / InChI

Molecular Formula C7H9ClO4
Molecular Weight 192.597
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:22:17 GMT 2023
Edited
by admin
on Sat Dec 16 01:22:17 GMT 2023
Record UNII
BC85JPR5IM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-CHLOROALLYLIDENE-3,3-DIACETATE
Common Name English
NSC-6252
Code English
2-PROPENE-1,1-DIOL, 2-CHLORO-, DIACETATE
Systematic Name English
2-PROPENE-1,1-DIOL, 2-CHLORO-, 1,1-DIACETATE
Common Name English
NSC-49607
Code English
Code System Code Type Description
CAS
5459-90-5
Created by admin on Sat Dec 16 01:22:17 GMT 2023 , Edited by admin on Sat Dec 16 01:22:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID50203024
Created by admin on Sat Dec 16 01:22:17 GMT 2023 , Edited by admin on Sat Dec 16 01:22:17 GMT 2023
PRIMARY
PUBCHEM
79576
Created by admin on Sat Dec 16 01:22:17 GMT 2023 , Edited by admin on Sat Dec 16 01:22:17 GMT 2023
PRIMARY
FDA UNII
BC85JPR5IM
Created by admin on Sat Dec 16 01:22:17 GMT 2023 , Edited by admin on Sat Dec 16 01:22:17 GMT 2023
PRIMARY
NSC
6252
Created by admin on Sat Dec 16 01:22:17 GMT 2023 , Edited by admin on Sat Dec 16 01:22:17 GMT 2023
PRIMARY
NSC
49607
Created by admin on Sat Dec 16 01:22:17 GMT 2023 , Edited by admin on Sat Dec 16 01:22:17 GMT 2023
PRIMARY