methyl 3-methyl-4-(methylamino)benzoate

methyl 3-methyl-4-(methylamino)benzoate

CAS: 700834-17-9

Formula: C10H13NO2

SMILES: CNC1=CC=C(C=C1C)C(=O)OC

IUPAC: methyl 3-methyl-4-(methylamino)benzoate

InChI: InChI=1S/C10H13NO2/c1-7-6-8(10(12)13-3)4-5-9(7)11-2/h4-6,11H,1-3H3

Composition: C (67.02%), H (7.31%), N (7.82%), O (17.85%)

Molar Mass: 179.219

Atom Count: 26

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	179.094628663
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KXLKPUTVQXKMCD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.32
Topological Polar Surface Area	38.33
Polarizability	19.49
Ring Count	1
Rotatable Bond Count	3

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