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81112-28-9 | Carbonic acid, methyl 2-methyl-2-propenyl ester
CAS No: 81112-28-9 Catalog No: AG00561G MDL No:
Product Description
Catalog Number:
AG00561G
Chemical Name:
Carbonic acid, methyl 2-methyl-2-propenyl ester
CAS Number:
81112-28-9
Molecular Formula:
C6H10O3
Molecular Weight:
130.1418
IUPAC Name:
methyl 2-methylprop-2-enyl carbonate
InChI:
InChI=1S/C6H10O3/c1-5(2)4-9-6(7)8-3/h1,4H2,2-3H3
InChI Key:
RIWCJNDORYUVSZ-UHFFFAOYSA-N
SMILES:
COC(=O)OCC(=C)C
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.063g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.143g/mol
Monoisotopic Mass:
130.063g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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