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Chrysanthemic acid, cis-(+)-

HCID 33606
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
26771-11-9
Standard SMILES
CC(C)=C[C@H]1[C@@H](C(=O)O)C1(C)C
InChIKey
XLOPRKKSAJMMEW-YUMQZZPRSA-N
Molecular formula
C10H16O2
Average molar mass
168.23 g/mol
Monoisotopic mass
168.11502975

Overview

(+)-cis-chrysanthemic acid is a cis-chrysanthemic acid. It is an enantiomer of a (-)-cis-chrysanthemic acid.

Names & identifiers

Preferred name
Chrysanthemic acid, cis-(+)-
IUPAC
trans-(1R,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylic acid

Names & synonyms

Chrysanthemic acid, cis-(+)-5P7V8620AMCyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1R,3S)-Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1R,3S)-rel-RefChem:577058DTXSID30883540(+)-cis-chrysanthemic acidcis-(+)-Chrysanthemic acid(1R)-cis-Chrysanthemic acid26771-11-9(+)-cis-Chrysanthemumic acid(1R,3S)-Chrysanthemic acid
Show more names
2935-23-1Chrysanthemic acid dl-cis-form15259-78-6(+)-cis-Chrysanthemumsaeure(1R,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylic acid1J3B3RQ0Q8(1R,3S)-2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylic acid(1R,3S)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylic acid

Database identifiers

CAS
26771-11-9、2935-23-1
PubChem CID
33606
ChEBI
CHEBI:39104
UNII
1J3B3RQ0Q8、5P7V8620AM
EC Number
220-908-2、247-996-5
Nikkaji
J232.119J

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
234

Experimental & physicochemical properties

LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]

Chemistry & industry

Uses & manufacturing

General Manufacturing Information · 2 items

Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1R,3S)-rel-: INACTIVE

Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1R,3S)-: INACTIVE

Related reactions

3 records
New reaction record
HRID 1198852 reaction equation
HRID 1198852As reactantuspto-grants-1990_02
HRID 1198853 reaction equation
HRID 1198853As reactantuspto-grants-1990_02
HRID 1198854 reaction equation
HRID 1198854As reactantuspto-grants-1990_02

Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes