2-Propylvaleryl chloride

CAT: 0024-sc-260106Size: 2.5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-260106Size:2.5 g

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CAS Number

2936-08-5

Chemical Information

2-Propylvaleryl chloride

CAS Number	2936-08-5
PubChem CID	76240
IUPAC Name	2-propylpentanoyl chloride
Molecular Formula	C8H15ClO
Molecular Weight	162.66
XLogP	3.7
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Heavy Atom Count	10
Formal Charge	0
Complexity	95

SMILES

CCCC(CCC)C(=O)Cl

InChI

InChI=1S/C8H15ClO/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3

InChIKey

PITHYUDHKJKJNQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2936-08-5

CID: 76240

Formula: C8H15ClO

MW: 162.66

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.66
XLogP3	3.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	162.0811428
Monoisotopic Mass	162.0811428
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	95.4
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
sc-275207	2,2-Dimethylbutyryl chloride
sc-288346	2,2-Diphenylethanesulfonyl chloride
sc-288346A	2,2-Diphenylethanesulfonyl chloride
sc-230663	2-Quinoxaloyl chloride
sc-251774	2-Mesitylenesulfonyl chloride
sc-230333	2-Fluorobenzenesulfonyl chloride
sc-274733	2-Chlorobutyryl chloride
sc-230637	2-Phenylbutyryl chloride
sc-230595	2-Nitrobenzenesulfonyl chloride
sc-254178	2-Bromobenzenesulfonyl chloride

Catalog	Name
AR-M04944-01	Mivacurium Chloride Impurity 2 Chloride
820010	2‐TRIMETHYLSILYL ETHOXYMETHYL CHLORIDE (SEM CHLORIDE)
106500 100	2-Furoyl Chloride for Synthesis (Furan-2-Carbonyl Chloride)
FD82666-01	2,2-Difluoroethanesulfonyl chloride
D478010	2,2-Dimethylpropanoyl Chloride
OR12707-01	2,2-Diphenylethylsulphonyl chloride
419294-01	2,2-Difluorocyclopropanesulfonyl Chloride
TRC-D471465-10G	2,2-Dimethylbutanoyl Chloride
274115-01	2,2-Diphenylethanesulfonyl Chloride
RG-D030807-01	2,2-Dichloroacetyl Chloride