5-Methylcyclopent-1-ene-1-carboxylic acid
Basic information
- CAS
53623-50-0- Standard SMILES
CC1CCC=C1C(=O)O- InChIKey
WDJACUIKSWQWOE-UHFFFAOYSA-N- Molecular formula
- C7H10O2
- Average molar mass
- 126.15 g/mol
- Monoisotopic mass
- 126.06807956
Names & identifiers
- Preferred name
- 5-Methylcyclopent-1-ene-1-carboxylic acid
- IUPAC
- 5-methylcyclopentene-1-carboxylic acid
- English name
- 1-Cyclopentene-1-carboxylic acid, 5-methyl- (9CI)
- Molecular formula
- C7H10O2
- Molecular weight
- 126.15
Names & synonyms
5-Methylcyclopent-1-ene-1-carboxylic acid53623-50-0RefChem:537250977-379-21-Cyclopentene-1-carboxylic acid, 5-methyl- (9CI)SCHEMBL1242465WDJACUIKSWQWOE-UHFFFAOYSA-NAKOS0063755395-Methyl-1-cyclopentene-1-carboxylic acid #EN300-1123891-Cyclopentene-1-carboxylic acid, 5-methyl-
Database identifiers
- CAS
53623-50-0- PubChem CID
- 557307
- EC Number
- 977-379-2
- Nikkaji
- J591.512K
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 158
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
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Related reactions
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Compound notes
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