Basic information
- CAS
22094-81-1- Standard SMILES
CCCCC1CC2C=CC1C2- InChIKey
YSWATWCBYRBYBO-UHFFFAOYSA-N- Molecular formula
- C11H18
- Average molar mass
- 150.26 g/mol
- Monoisotopic mass
- 150.14085057
Names & identifiers
- Preferred name
- Bicyclo[2.2.1]hept-2-ene, 5-butyl-
- IUPAC
- 5-butylbicyclo[2.2.1]hept-2-ene
- English name
- 6-butylbicyclo[2.2.1]hept-2-ene
- Molecular formula
- C11H18
- Molecular weight
- 150.26
Names & synonyms
Bicyclo[2.2.1]hept-2-ene, 5-butyl-DTXSID00885192Bicyclo(2.2.1)hept-2-ene, 5-butyl-RefChem:568294DTXCID80102458622094-81-15-butylbicyclo[2.2.1]hept-2-ene5-butyl-2-norbornene5-ButylnorborneneBicyclo[2.2.1]hept-2-ene,5-butyl-5-butyinorborneneSCHEMBL107841
Show more names
5-butylbicyclohept-2-ene6-butylbicyclo[2.2.1]hept-2-ene
SCHEMBL1478459SCHEMBL8510952SCHEMBL8510953AT45305DB-398322
Database identifiers
- CAS
22094-81-1- PubChem CID
- 168020
- DTXSID
DTXSID00885192- Nikkaji
- J1.229.865J
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 157
Physicochemical properties
- Boiling point
- 196.6 · 196.6±7.0 °C(Predicted)
- Density
- 0.888 · 0.888±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- 2.2 · Bicyclo[2.2.1]hept-2-ene, 5-butyl- (22094-81-1)
- TSCA
- TSCA listed
Safety & regulation
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Regulatory information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBicyclo[2.2.1]hept-2-ene, 5-butyl-: ACTIVE
Suppliers18 total
南京凯美西化工有限公司02558748998 18951874644 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
江苏律恒生物医药有限公司18936227980
上海钰康生物科技有限公司15618758386 15618758386 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海金赛生物科技有限公司189-1821-4718 18918214718
杭州杰恒化工有限公司0571-87396432 · [email protected]
湖北赛恩斯化工有限公司15994282563 15994282563 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
湖北中隆康盛精细化工有限公司027-83855385 13407122916 · [email protected]
南京艾瑞博生物科技有限公司19951442182
湖北中隆康盛精细化工有限公司027-027-83850178 18162590268 · [email protected]
常州英飒医药科技有限公司15151934985 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
Chemsigma International Co., Ltd.+86-2558742998 +86-19951791336 · [email protected]
Dideu Industries Group Limited+8617392712697 · [email protected]
Related reactions
13 records
Compound notes
Loading…