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Basic information
- CAS
1617-22-7- Standard SMILES
CCOC(=O)C1=CCCCC1- InChIKey
HDKVSEUEUWKMFS-UHFFFAOYSA-N- Molecular formula
- C9H14O2
- Average molar mass
- 154.21 g/mol
- Monoisotopic mass
- 154.09937969
Names & identifiers
- Preferred name
- 1-Cyclohexene-1-carboxylic acid, ethyl ester
- IUPAC
- ethyl cyclohexene-1-carboxylate
- English name
- ethyl cyclohexenecarboxylate
- Molecular formula
- C9H14O2
- Molecular weight
- 154.21
Names & synonyms
1617-22-7Ethyl cyclohexenecarboxylate1-Cyclohexene-1-carboxylic acid, ethyl esterDTXSID00167223RefChem:1055289DTXCID1089714216-571-6ethyl cyclohex-1-ene-1-carboxylateethyl cyclohexene-1-carboxylateethyl cyclohex-1-enecarboxylateEINECS 216-571-6Cyclohexenecarboxylic acid, ethyl ester
Show more names
Cyclohex-1-enecarboxylic acid ethyl ester1-Cyclohexene-1-carboxylic acid ethyl ester
SCHEMBL6049107SCHEMBL10411057ethyl 1-cyclohexene-1-carboxylateethylcyclohex-1-ene-1-carboxylateBAA61722AKOS006294483cyclohexene-1-carboxylic acid ethyl esterDB-342846
Database identifiers
- CAS
1617-22-7- PubChem CID
- 74173
- DTXSID
DTXSID00167223- EC Number
- 216-571-6
- Nikkaji
- J195.239K
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 170
Physicochemical properties
- Boiling point
- 108 · 108-110 °C(Press: 20 Torr)
- Density
- 1.0032 g/cm3 · 1.0032 g/cm3(Temp: 14.15 °C)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers8 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
武汉易谊化学科技有限公司0711-3617768 13308685235 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]
Golden Pharma Co., Limited+86-18958062155 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
1 records
Compound notes
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