1-Chloropentan-2-one

CAT: 0127-OR1072501-01Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1072501-01Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

19265-24-8

MDL Number

MFCD16167605

Purity

95%

Smiles

CCCC(CCl)=O

Chemical Information

1-Chloropentan-2-one

CAS Number	19265-24-8
PubChem CID	11286463
IUPAC Name	1-chloropentan-2-one
Molecular Formula	C5H9ClO
Molecular Weight	120.58
XLogP	1.4
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	7
Formal Charge	0
Complexity	61

SMILES

CCCC(=O)CCl

InChI

InChI=1S/C5H9ClO/c1-2-3-5(7)4-6/h2-4H2,1H3

InChIKey

MGTGUEKJBFTQQW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19265-24-8

CID: 11286463

Formula: C5H9ClO

MW: 120.58

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	120.58
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	120.0341926
Monoisotopic Mass	120.0341926
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	61.1
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
RG-C121505-01	2-Chloropentan-3-One
SAA65832-01	1-Chloropentan-2-ol
DXC58426-01	1-Amino-4-chloropentan-2-one hydrochloride
RG-A263032-01	4-Chloropentan-1-Ol
QAA14694-01	5-Chloropentan-2-ol
ECA87412-01	1- (4-Bromophenyl) -5-chloropentan-1-one
HY-W038345	5-Chloropentan-1-ol
NBA46113-01	2,2-Dimethoxycyclohexan-1-one
HAA22852-01	2,2-Dimethylcycloheptan-1-one
BAA19214-01	2,2-Dimethylcyclobutan-1-one