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Details

Stereochemistry MIXED
Molecular Formula C10H14O4
Molecular Weight 198.2158
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CHRYSANTHEMUMDICARBOXYLIC ACID

SMILES

CC(=CC1C(C(O)=O)C1(C)C)C(O)=O

InChI

InChIKey=XXTFGUFRXPWYDA-SNAWJCMRSA-N
InChI=1S/C10H14O4/c1-5(8(11)12)4-6-7(9(13)14)10(6,2)3/h4,6-7H,1-3H3,(H,11,12)(H,13,14)/b5-4+

HIDE SMILES / InChI

Molecular Formula C10H14O4
Molecular Weight 198.2158
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:38:20 GMT 2023
Edited
by admin
on Sat Dec 16 08:38:20 GMT 2023
Record UNII
2CZ3RD4DDE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CHRYSANTHEMUMDICARBOXYLIC ACID
Common Name English
3-(2-CARBOXY-1-PROPEN-1-YL)-2,2-DIMETHYLCYCLOPROPANECARBOXYLIC ACID
Systematic Name English
CYCLOPROPANECARBOXYLIC ACID, 3-(2-CARBOXY-1-PROPEN-1-YL)-2,2-DIMETHYL-
Systematic Name English
CYCLOPROPANEACRYLIC ACID, 3-CARBOXY-.ALPHA.,2,2-TRIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
5370021
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID40964354
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
FDA UNII
2CZ3RD4DDE
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
CAS
497-95-0
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY