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86240-55-3 | Cyclopentanecarbonylchloride, 1,3-dimethyl-2-oxo-
CAS No: 86240-55-3 Catalog No: AG004S3T MDL No:
Product Description
Catalog Number:
AG004S3T
Chemical Name:
Cyclopentanecarbonylchloride, 1,3-dimethyl-2-oxo-
CAS Number:
86240-55-3
Molecular Formula:
C8H11ClO2
Molecular Weight:
174.6247
IUPAC Name:
1,3-dimethyl-2-oxocyclopentane-1-carbonyl chloride
InChI:
InChI=1S/C8H11ClO2/c1-5-3-4-8(2,6(5)10)7(9)11/h5H,3-4H2,1-2H3
InChI Key:
XHIJFARHKDLGIQ-UHFFFAOYSA-N
SMILES:
CC1(CCC(C1=O)C)C(=O)Cl
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.045g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.624g/mol
Monoisotopic Mass:
174.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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