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86242-41-3 | methyl 4-(dimethylamino)-3-methoxybut-2-enoate
CAS No: 86242-41-3 Catalog No: AG004JTC MDL No:
Product Description
Catalog Number:
AG004JTC
Chemical Name:
methyl 4-(dimethylamino)-3-methoxybut-2-enoate
CAS Number:
86242-41-3
Molecular Formula:
C8H15NO3
Molecular Weight:
173.2096
IUPAC Name:
methyl 4-(dimethylamino)-3-methoxybut-2-enoate
InChI:
InChI=1S/C8H15NO3/c1-9(2)6-7(11-3)5-8(10)12-4/h5H,6H2,1-4H3
InChI Key:
BUTXFWOZFVEDCZ-UHFFFAOYSA-N
SMILES:
COC(=CC(=O)OC)CN(C)C
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.105g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.212g/mol
Monoisotopic Mass:
173.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.2
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