Bornylene

HCID 10047CAS 464-17-5
Substructure searchFind similar structures

Basic information

Standard SMILES
CC12C=CC(CC1)C2(C)C
InChIKey
KUKRLSJNTMLPPK-UHFFFAOYSA-N
Molecular formula
C10H16
Average molar mass
136.23 g/mol
Monoisotopic mass
136.12520051

Overview

bornylene has been reported in Thymus eigii, Rhanterium epapposum, and other organisms with data available.

Names & identifiers

Preferred name
Bornylene
IUPAC
1,7,7-trimethylbicyclo[2.2.1]hept-2-ene
English name
2-Bornene
Molecular formula
C10H16
Molecular weight
136.23

Names & synonyms

Bornylene2-Bornene464-17-51,7,7-TRIMETHYLBICYCLO[2.2.1]HEPT-2-ENE1,7,7-Trimethylnorbornene1,7,7-Trimethyl-2-norborneneF7WB27RKZC1,7,7-Trimethylbicyclo(2.2.1)hept-2-eneNSC-193373DTXSID20870545Bicyclo(2.2.1)hept-2-ene, 1,7,7-trimethyl-Bicyclo[2.2.1]hept-2-ene, 1,7,7-trimethyl-
Show more names
4,7,7-trimethylbicyclo[2.2.1]hept-2-ene
RefChem:121027DTXCID80818261borneneNSC 193373.ALPHA.-BORNENE1,7-TrimethylnorborneneUNII-F7WB27RKZC1,7-Trimethyl-2-norbornene

Database identifiers

CAS
464-17-5
PubChem CID
10047
DTXSID
DTXSID20870545
UNII
F7WB27RKZC
Nikkaji
J5.884J、J95.595G

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
10

Physicochemical properties

Melting point
113 °C · 113°C
Boiling point
185.55 °C · 185.55°C (rough estimate)
Density
0.8455 · 0.8455 (estimate)
refractive index
1.486 · 1.4860 (estimate)
LogP
4.187 · 4.187 (est)
FDA UNII
7 WB27RKZC · F7WB27RKZC

Chemistry & industry

Upstream & downstream products

Suppliers7 total

北京科迈启医药科技有限公司15910349257 15910349257 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
BOC Sciences[email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]

Related reactions

1 records
New reaction record

Linked notes

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