Basic information
- CAS
694-35-9- Standard SMILES
CCC1C=CCC1- InChIKey
HICUGGYRYZOXJI-UHFFFAOYSA-N- Molecular formula
- C7H12
- Average molar mass
- 96.17 g/mol
- Monoisotopic mass
- 96.09390038
Names & identifiers
- Preferred name
- 3-Ethylcyclopentene
- IUPAC
- 3-ethylcyclopentene
- English name
- 3-ETHYL-1-CYCLOPENTENE
- Molecular formula
- C7H12
- Molecular weight
- 96.17
Names & synonyms
3-Ethylcyclopentene3-Ethyl-1-cyclopenteneCyclopentene, 3-ethyl-694-35-93-Ethylcyclopentene-1EINECS 211-770-4NSC 74128RefChem:93848211-770-4HICUGGYRYZOXJI-UHFFFAOYSA-N3-ethylcyclopent-1-eneNSC74128
Show more names
cyclopentene,3-ethyl-
SCHEMBL72927SCHEMBL72928SCHEMBL542574SCHEMBL911047SCHEMBL1902108SCHEMBL9503308DTXSID10870756NSC-74128
Database identifiers
- CAS
694-35-9- PubChem CID
- 79095
- DTXSID
DTXSID10870756- EC Number
- 211-770-4
- Nikkaji
- J102.036F
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 72.1
Physicochemical properties
- Melting point
- -108.93 °C · -108.93°C (estimate)
- Boiling point
- 97.85 °C · 97.85°C
- Density
- 0.7784 · 0.7784
- refractive index
- 1.4291 · 1.4291
- CAS DataBase Reference
- 694 · 694-35-9
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- Risk Statements
- 11 · 11
- Safety Statements
- 9 · 9-16-33
- RIDADR
- 3295 · 3295
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- ridadr
- 3295
- risk_code
- 11
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 9-16-33
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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