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101970-86-9 | Carbonic acid, methyl trichloromethyl ester
CAS No: 101970-86-9 Catalog No: AG00064S MDL No:
Product Description
Catalog Number:
AG00064S
Chemical Name:
Carbonic acid, methyl trichloromethyl ester
CAS Number:
101970-86-9
Molecular Formula:
C3H3Cl3O3
Molecular Weight:
193.4131
IUPAC Name:
methyl trichloromethyl carbonate
InChI:
InChI=1S/C3H3Cl3O3/c1-8-2(7)9-3(4,5)6/h1H3
InChI Key:
KYZWAJMFZBMJEN-UHFFFAOYSA-N
SMILES:
COC(=O)OC(Cl)(Cl)Cl
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.915g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.404g/mol
Monoisotopic Mass:
191.915g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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