methyl 3-amino-2-hydroxy-5-methylbenzoate

methyl 3-amino-2-hydroxy-5-methylbenzoate

CAS: 70978-07-3

Formula: C9H11NO3

SMILES: COC(=O)C1=C(O)C(N)=CC(C)=C1

IUPAC: methyl 3-amino-2-hydroxy-5-methylbenzoate

InChI: InChI=1S/C9H11NO3/c1-5-3-6(9(12)13-2)8(11)7(10)4-5/h3-4,11H,10H2,1-2H3

Composition: C (59.66%), H (6.12%), N (7.73%), O (26.49%)

Molar Mass: 181.191

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	181.073893218
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	BYDBTYDCQJZXAT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.81
Topological Polar Surface Area	72.55
Polarizability	18.29
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	70978-07-3		$51.35-$674.07$51.35$63.37$86.31$143.12$225.06$674.07