U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H7ClO3
Molecular Weight 186.592
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(CHLOROACETYL)CATECHOL

SMILES

OC1=C(O)C=C(C=C1)C(=O)CCl

InChI

InChIKey=LWTJEJCZJFZKEL-UHFFFAOYSA-N
InChI=1S/C8H7ClO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,10-11H,4H2

HIDE SMILES / InChI

Molecular Formula C8H7ClO3
Molecular Weight 186.592
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 02:17:14 GMT 2023
Edited
by admin
on Sat Dec 16 02:17:14 GMT 2023
Record UNII
FN6949L56Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(CHLOROACETYL)CATECHOL
Systematic Name English
2-CHLORO-1-(3,4-DIHYDROXYPHENYL)-1-ETHANONE
Systematic Name English
NSC-13905
Code English
NORADRENALINE TARTRATE IMPURITY E [EP IMPURITY]
Common Name English
.ALPHA.-CHLORO-3',4'-DIHYDROXYACETOPHENONE
Systematic Name English
ETHANONE, 2-CHLORO-1-(3,4-DIHYDROXYPHENYL)-
Systematic Name English
ACETOPHENONE, .ALPHA.-CHLORO-3,4-DIHYDROXY-
Common Name English
ACETOPHENONE, 2-CHLORO-3',4'-DIHYDROXY-
Systematic Name English
2-CHLORO-3',4'-DIHYDROXYACETOPHENONE
Systematic Name English
3,4-DIHYDROXYPHENACYL CHLORIDE
Systematic Name English
2-CHLORO-1-(3,4-DIHYDROXYPHENYL)ETHANONE
Systematic Name English
NSC-17869
Code English
1-CHLOROACETYL-3,4-DIHYDROXYBENZENE
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
202-754-8
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
CHEBI
51844
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID90243929
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
PUBCHEM
66834
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
NSC
17869
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
NSC
13905
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
FDA UNII
FN6949L56Q
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
CAS
99-40-1
Created by admin on Sat Dec 16 02:17:14 GMT 2023 , Edited by admin on Sat Dec 16 02:17:14 GMT 2023
PRIMARY
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