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76336-16-8 | Methyl 2-amino-4-methylnicotinate
CAS No: 76336-16-8 Catalog No: AG005634 MDL No:MFCD09837641
Product Description
Catalog Number:
AG005634
Chemical Name:
Methyl 2-amino-4-methylnicotinate
CAS Number:
76336-16-8
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD09837641
IUPAC Name:
methyl 2-amino-4-methylpyridine-3-carboxylate
InChI:
InChI=1S/C8H10N2O2/c1-5-3-4-10-7(9)6(5)8(11)12-2/h3-4H,1-2H3,(H2,9,10)
InChI Key:
LEZPWOSVPDIICC-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(C)ccnc1N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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