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16200-72-9 | Cyclobutanecarbonyl chloride, 3-chloro-3-methyl-
CAS No: 16200-72-9 Catalog No: AG001SN0 MDL No:
Product Description
Catalog Number:
AG001SN0
Chemical Name:
Cyclobutanecarbonyl chloride, 3-chloro-3-methyl-
CAS Number:
16200-72-9
Molecular Formula:
C6H8Cl2O
Molecular Weight:
167.0331
IUPAC Name:
3-chloro-3-methylcyclobutane-1-carbonyl chloride
InChI:
InChI=1S/C6H8Cl2O/c1-6(8)2-4(3-6)5(7)9/h4H,2-3H2,1H3
InChI Key:
FRUBTPVBFZICAQ-UHFFFAOYSA-N
SMILES:
ClC(=O)C1CC(C1)(C)Cl
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.995g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.029g/mol
Monoisotopic Mass:
165.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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