4-Methylvaleryl Chloride

CAT: 0024-sc-485792Size: 25 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-485792Size:25 mL

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CAS Number

38136-29-7

Chemical Information

Pentanoyl chloride, 4-methyl-

CAS Number	38136-29-7
PubChem CID	170008
IUPAC Name	4-methylpentanoyl chloride
Molecular Formula	C6H11ClO
Molecular Weight	134.60
XLogP	2.4
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	8
Formal Charge	0
Complexity	78

SMILES

CC(C)CCC(=O)Cl

InChI

InChI=1S/C6H11ClO/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3

InChIKey

SVWCVXFHTHCJJB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 38136-29-7

CID: 170008

Formula: C6H11ClO

MW: 134.60

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	134.60
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	134.0498427
Monoisotopic Mass	134.0498427
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	78.6
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-230569	2-Methylvaleryl chloride
sc-276349	3-Methylvaleryl chloride
sc-485211	4,4'-Biphenyldicarbonyl Chloride
sc-252213	4,4'-Dimethoxytriphenylmethyl chloride
sc-238985A	4,4',4''-Trimethoxytrityl chloride
sc-238985	4,4',4''-Trimethoxytrityl chloride
sc-256821A	4-Phenoxybenzoyl chloride
sc-267189	4-Acetamidobenzoyl chloride
sc-323143	4-Fluorobenzhydryl chloride
sc-238847A	4-Fluorobenzenesulfonyl chloride

Catalog	Name
FM71732-01	4-Methylvaleryl chloride
5238-27-7	2-METHYLVALERYL CHLORIDE
AR-V01052-01	4-Chlorovaleroyl Chloride (4-Chloropentanoyl Chloride)
E37F 2030-1 g	DABSYL chloride [4-Dimethylaminoazobenzene-4-sulfonyl chloride]
AR-M04946-01	Mivacurium Chloride Impurity 4 Chloride
E37F-2030	DABSYL-chloride-[4-Dimethylaminoazobenzene-4-sulfonyl-chloride]
704010	4,4′‐DIMETHOXYTRITYL CHLORIDE
TRC-O870630-5G	4,4’-Oxydibenzenesulfonyl Chloride
3406-84-6	4,4'-BIPHENYLDISULFONYL CHLORIDE
TRC-D461115-10G	4,4'-Dimethoxytrityl Chloride