Myrcene

CAT: 1596-AR-M02453-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-M02453-02Size:25 Units

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CAS Number

123-35-3

Synonyms

7-methyl-3-methyleneocta-1,6-diene;7-Methyl-3-methylene-1,6-octadiene; 2-Methyl-6-methylene-2,7-octadiene; 3-Methylene-7-methyl-1,6-octadiene; Myrcene; NSC 406264; ?-Geraniolene; Myrcene; ?-Myrcene (>90%)

Molecular Formula

C10H16

Molecular Weight

136.24

API Name

Myrcene

Chemical Information

Myrcene

beta-Myrcene can cause cancer according to The National Toxicology Program.

CAS Number	123-35-3
PubChem CID	31253
IUPAC Name	7-methyl-3-methylideneocta-1,6-diene
Molecular Formula	C10H16
Molecular Weight	136.23
XLogP	4.3
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	4
Heavy Atom Count	10
Formal Charge	0
Complexity	145

SMILES

CC(=CCCC(=C)C=C)C

InChI

InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3

InChIKey

UAHWPYUMFXYFJY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 123-35-3

CID: 31253

Formula: C10H16

MW: 136.23

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	136.23
XLogP3	4.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	4
Exact Mass	136.125200510
Monoisotopic Mass	136.125200510
Topological Polar Surface Area	0 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	145
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
284773-01	Myrcene (β-Myrcene)
OR1013923-01	Myrcene
sc-207898	β-Myrcene
sc-211941A	β-Myrcene-d6
HY-N0803S	Myrcene-d6
TRC-M875302-2.5MG	Beta-Myrcene-d6
TRC-M875300-1G	beta-Myrcene (>90%)
HY-N0803S1-01	Myrcene-13C3
FM59691-01	Myrcene - 75%
HY-N0803R-01	Myrcene (Standard)

Myrcene

Chemical Information

Alternative Products

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