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1263365-96-3 | 6-Chloro-1-(1,3-dioxolan-2-yl)-hexan-2-one
CAS No: 1263365-96-3 Catalog No: AG01FB7P MDL No:
Product Description
Catalog Number:
AG01FB7P
Chemical Name:
6-Chloro-1-(1,3-dioxolan-2-yl)-hexan-2-one
CAS Number:
1263365-96-3
Molecular Formula:
C9H15ClO3
Molecular Weight:
206.6666
IUPAC Name:
6-chloro-1-(1,3-dioxolan-2-yl)hexan-2-one
InChI:
InChI=1S/C9H15ClO3/c10-4-2-1-3-8(11)7-9-12-5-6-13-9/h9H,1-7H2
InChI Key:
KKPPJMGLSJKICW-UHFFFAOYSA-N
SMILES:
ClCCCCC(=O)CC1OCCO1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.071g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.666g/mol
Monoisotopic Mass:
206.071g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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