3-methoxy-4-(methylamino)benzoic acid

3-methoxy-4-(methylamino)benzoic acid

CAS: 500690-02-8

Formula: C9H11NO3

SMILES: CNC1=CC=C(C=C1OC)C(O)=O

IUPAC: 3-methoxy-4-(methylamino)benzoic acid

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

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	4
Hydrogen Bond Donor Count	2
InChIKey	GQVAGDPAHFLKQI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.97
Topological Polar Surface Area	58.56
Polarizability	18.18
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	500690-02-8		$341.55-$1,570.10$341.55$582.71$1,570.10

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<6 Days	500690-02-8		$256.45-$1,245.45$256.45$450.80$1,245.45