Heptene

CAT: 1596-AR-H01087-03Size: 50 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-H01087-03Size:50 Units

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CAS Number

592-76-7

Synonyms

Hept-1-ene; Heptylene; n-Hept-1-ene; 1-n-Heptene; n-Heptene

Molecular Formula

C7H14

Molecular Weight

98.19

API Name

Heptene

Chemical Information

1-Heptene

1-Heptene is a hydrocarbon.

CAS Number	592-76-7
PubChem CID	11610
IUPAC Name	hept-1-ene
Molecular Formula	C7H14
Molecular Weight	98.19
XLogP	4
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	4
Heavy Atom Count	7
Formal Charge	0
Complexity	37

SMILES

CCCCCC=C

InChI

InChI=1S/C7H14/c1-3-5-7-6-4-2/h3H,1,4-7H2,2H3

InChIKey

ZGEGCLOFRBLKSE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 592-76-7

CID: 11610

Formula: C7H14

MW: 98.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	98.19
XLogP3	4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	4
Exact Mass	98.109550447
Monoisotopic Mass	98.109550447
Topological Polar Surface Area	0 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	37.3
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

Catalog	Name
AR-M02975-01	N-Heptane
AR-H01075-01	3-[ (1,1-Dimethylethoxy) methyl]heptane
AR-M03091-01	Heptane-1,1,7-tricarboxylic acid
AR-M02925-01	6-Methyl-5-Hepten-2-One
AR-A07868-01	2-Oxa-6-Azaspiro[3.3]heptane
AR-M03090-01	Heptane-1,1,7,7-tetracarboxilic acid
AR-M03089-01	Tetraethyl heptane-1,1,7,7-tetracarboxylate
AR-A07745-01	6- (methylsulfonyl) -2-Azaspiro[3.3]heptane hydrochloride
AR-B08088-01	3- (Hydroxymethyl) heptan-4-yl Butanoate
AR-A07870-01	2-Thia-6-Azaspiro[3.3]heptane 2,2-dioxide HCl