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2-Ethenyl-6,6-dimethylbicyclo[3.1.1]hept-2-ene

HCID 253229
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
473-00-7
Standard SMILES
C=CC1=CCC2CC1C2(C)C
InChIKey
HSBGCCSTQMHQPR-UHFFFAOYSA-N
Molecular formula
C11H16
Average molar mass
148.24 g/mol
Monoisotopic mass
148.12520051

Names & identifiers

Preferred name
2-Ethenyl-6,6-dimethylbicyclo[3.1.1]hept-2-ene
IUPAC
2-ethenyl-6,6-dimethylbicyclo[3.1.1]hept-2-ene
English name
2-Vinyl-6,6-dimethylbicyclo[3.1.1]hept-2-ene
Molecular weight
0

Names & synonyms

473-00-72-ethenyl-6,6-dimethylbicyclo[3.1.1]hept-2-eneNopadiene6,6-dimethyl-2-vinylbicyclo[3.1.1]hept-2-eneNSC75876SCHEMBL11074361DTXSID70291488NSC-75876EN300-18389236,6-dimethyl-2-vinylbi-cyclo[3.1.1]hept-2-eneNSC 75876; 6,6-dimethyl-2-vinylbicyclo[3.1.1]hept-2-enePividium bromide impurity 2
Show more names
2-Vinyl-6,6-dimethylbicyclo[3.1.1]hept-2-ene

Database identifiers

CAS
473-00-7
PubChem CID
253229
DTXSID
DTXSID70291488
EC Number
106-086-7
Nikkaji
J12.072C

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
220

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 · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, P391, 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 CategoriesAcute Tox. 4 (100%)

Chemistry & industry

Suppliers2 total

深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
南京宁吉通医药生物科技有限公司0-19710401727 19710401727 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes