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162691-14-7 | Carbonic acid, chloromethyl 2,2-dimethylpropyl ester
CAS No: 162691-14-7 Catalog No: AG001TC8 MDL No:
Product Description
Catalog Number:
AG001TC8
Chemical Name:
Carbonic acid, chloromethyl 2,2-dimethylpropyl ester
CAS Number:
162691-14-7
Molecular Formula:
C7H13ClO3
Molecular Weight:
180.6293
IUPAC Name:
chloromethyl 2,2-dimethylpropyl carbonate
InChI:
InChI=1S/C7H13ClO3/c1-7(2,3)4-10-6(9)11-5-8/h4-5H2,1-3H3
InChI Key:
VOYXHVPLPQAGKJ-UHFFFAOYSA-N
SMILES:
ClCOC(=O)OCC(C)(C)C
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.055g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.628g/mol
Monoisotopic Mass:
180.055g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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