Products for Research Use Only
RegisterLogin

1-Chloropinacolone

CAT: 0063-32045726Size: 25 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0063-32045726Size:25 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
13547-70-1

Chemical Information

1-Chloropinacolone
CAS Number13547-70-1
PubChem CID83572
IUPAC Name1-chloro-3,3-dimethylbutan-2-one
Molecular FormulaC6H11ClO
Molecular Weight134.60
XLogP2
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity91
SMILES
CC(C)(C)C(=O)CCl
InChI
InChI=1S/C6H11ClO/c1-6(2,3)5(8)4-7/h4H2,1-3H3
InChIKey
ULSAJQMHTGKPIY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Chloropinacolone
CAS: 13547-70-1
CID: 83572
Formula: C6H11ClO
MW: 134.60
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight134.60
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass134.0498427
Monoisotopic Mass134.0498427
Topological Polar Surface Area17.1 Ų
Heavy Atom Count8
Formal Charge0
Complexity91.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
899809551,1'-Ferrocenedicarboxaldehyde
513900821,1'- (Methylenedi-4,1-phenylene) bismaleimide
51390082-100g1,1'- (Methylenedi-4,1-phenylene) bismaleimide
27791922-100g1-Adamantanol (1-Hydroxyadamantane)
55112096-1g1,1-Cyclopropane dimethanol
27791922-250g1-Adamantanol (1-Hydroxyadamantane)
551120961,1-Cyclopropane dimethanol
27791922-011-Adamantanol (1-Hydroxyadamantane)
900263781-Phenyl-1-propanol
89990083Thiomorpholine-1,1-dioxide hydrochloride

Alternative Products

CatalogName
sc-2539241-Chloropinacolone
OF59775-011,1,1,1,1-Kestoheptaose
N2864-5.11,1,1,1-Kestohexaose
1120401,1,1,1-Kestohexose
410417-011,1,1-Trichloromethanesulfonic Acid 1,1'-Anhydride
IFA69273-011-Iodobicyclo[1.1.1]pentane
OR3123881-Phenylbicyclo[1.1.1]pentane
GTR19217879-01AMPK-α1β1γ1 activator 1

Popular Products