Cyclohex-2-en-1-ylacetic acid
Basic information
- CAS
3675-31-8- Standard SMILES
O=C(O)CC1C=CCCC1- InChIKey
ZCGVZRUPMCMONF-UHFFFAOYSA-N- Molecular formula
- C8H12O2
- Average molar mass
- 140.18 g/mol
- Monoisotopic mass
- 140.08372962
Names & identifiers
- Preferred name
- Cyclohex-2-en-1-ylacetic acid
- IUPAC
- 2-cyclohex-2-en-1-ylacetic acid
- English name
- 2-Cyclohexene-1-aceticacid
- Molecular formula
- C8H12O2
- Molecular weight
- 140.17968
Names & synonyms
3675-31-8cyclohex-2-en-1-ylacetic acidDTXSID90280839RefChem:335120DTXCID002319932-(cyclohex-2-en-1-yl)acetic acid2-cyclohex-2-en-1-ylacetic acid2-Cyclohexene-1-aceticacidMFCD09924887(2-Cyclohexenyl)acetic Acid2-Cyclohexene-1-acetic acidNSC18900
Show more names
trihydrobenzeneacetic acidSCHEMBL6077803SCHEMBL7038098ZCGVZRUPMCMONF-UHFFFAOYSA-N(Cyclohex-2-en-1-yl)acetic acid2-(cyclohex-2-en-1-yl)aceticacidDAA67531NSC-18900
Database identifiers
- CAS
3675-31-8- PubChem CID
- 227350
- DTXSID
DTXSID90280839- Nikkaji
- J452.732A
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Related reactions
2 records
Compound notes
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