A-Nonylcyclopropanemethanol

CAT: 0127-OR1042124-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1042124-01Size:100 mg

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CAS Number

1248098-13-6

MDL Number

MFCD16821085

Purity

95%

Smiles

OC(C1CC1)CCCCCCCCC

Chemical Information

1-Cyclopropyldecan-1-ol

CAS Number	1248098-13-6
PubChem CID	62608215
IUPAC Name	1-cyclopropyldecan-1-ol
Molecular Formula	C13H26O
Molecular Weight	198.34
XLogP	4.9
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	9
Heavy Atom Count	14
Formal Charge	0
Complexity	129

SMILES

CCCCCCCCCC(C1CC1)O

InChI

InChI=1S/C13H26O/c1-2-3-4-5-6-7-8-9-13(14)12-10-11-12/h12-14H,2-11H2,1H3

InChIKey

ACSOTVREZJQAJV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1248098-13-6

CID: 62608215

Formula: C13H26O

MW: 198.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	198.34
XLogP3	4.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	9
Exact Mass	198.198365449
Monoisotopic Mass	198.198365449
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	129
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes