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18370-95-1 | Methyl Trimethoxyacetate
CAS No: 18370-95-1 Catalog No: AG00387Z MDL No:MFCD09701200
Product Description
Catalog Number:
AG00387Z
Chemical Name:
Methyl Trimethoxyacetate
CAS Number:
18370-95-1
Molecular Formula:
C6H12O5
Molecular Weight:
164.1565
MDL Number:
MFCD09701200
IUPAC Name:
methyl 2,2,2-trimethoxyacetate
InChI:
InChI=1S/C6H12O5/c1-8-5(7)6(9-2,10-3)11-4/h1-4H3
InChI Key:
QTABOWCQAPYNPP-UHFFFAOYSA-N
SMILES:
COC(=O)C(OC)(OC)OC
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.157g/mol
Monoisotopic Mass:
164.068g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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