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(+)-3-Carene

(+)-3-Carene structure

CAS No:
498-15-7
Formula:
C10H16
Chemical Name:
(+)-3-Carene
Synonyms:
Bicyclo[4.1.0]hept-3-ene,3,7,7-trimethyl-,(1S,6R)-;3-Carene,(1S,6R)-(+)-;Bicyclo[4.1.0]hept-3-ene,3,7,7-trimethyl-,(1S)-;(1S,6R)-3,7,7-Trimethylbicyclo[4.1.0]hept-3-ene;Isodiprene;(+)-3-Carene;(+)-Carene-3;(1S,6R)-3-Carene;(S)-(+)-3-Carene;(+)-Δ3-Carene;(1S)-(+)-3-Carene;(1S)-3-Carene;19079-29-9;1217529-05-9;2166449-76-7;2310325-77-8
Categories:
Analytical Chemistry > Analysis Reagents

Description

ChEBI: A car-3-ene (3,7,7-trimethylbicyclo[4.1.0]hept-3-ene) that has S configuration at position 1 and R configuration at position 6.

(+)-car-3-ene is a car-3-ene (3,7,7-trimethylbicyclo[4.1.0]hept-3-ene) that has S configuration at position 1 and R configuration at position 6. It is an enantiomer of a (-)-car-3-ene.

(+)-3-Carene Basic Attributes

Molecular Weight：

136.23

Exact Mass：

136.23

EC Number：

207-856-6

UNII：

XBL40A7IA6

DSSTox ID：

DTXSID60858827

Characteristics

PSA：

XLogP3：

2.99870

Appearance：

clear very slightly yellow liquid (clear)

Density：

0.8561 g/cm³ @ Temp: 20 °C

Melting Point：

71-72 °C

Boiling Point：

167-170 °C

Flash Point：

131 °F

Refractive Index：

1.472

Water Solubility：

Insoluble in water; soluble in benzene, pet ether

Storage Conditions：

-20°C

Vapor Pressure：

1.86mmHg at 25°C

Specific rotation：

17 º (NEAT)

Safety Information

Hazard category：

Transport codes：

UN 2319 3/PG 3

wgk germany：

hazard class code：

10-50/53-43

safety instructions：

36/37-60-61

RTECS Number：

FH8400000

Marks：

Xi,N

Precautionary statement(s)：

P273-P280-P501

Hazard Statements：

H226-H317-H410

Drug Information

Metabolism/Metabolites：

(+)-3-carene has known human metabolites that include 3-Caren-10-ol and Carene epoxide.

MeSH Entry Terms：

(+)-3-carene

(+)-3-Carene Use and Manufacturing

Uses

Used in organic solvents and dyes, medicine and organic synthesis intermediates

Use Classification：

Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]

Computed Properties

Molecular Weight:136.23
XLogP3:2.8
Exact Mass:136.125200510
Monoisotopic Mass:136.125200510
Heavy Atom Count:10
Complexity:186
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Toluene

Isopentene / Isoamylene

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Guide of (+)-3-Carene

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Material
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(+)-3-Carene

SDS

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