methyl 5-(aminomethyl)-2-methylbenzoate hydrochloride

methyl 5-(aminomethyl)-2-methylbenzoate hydrochloride

CAS: 2153472-90-1

Formula: C10H14ClNO2

SMILES: Cl.COC(=O)C1=CC(CN)=CC=C1C

IUPAC: methyl 5-(aminomethyl)-2-methylbenzoate hydrochloride

InChI: InChI=1S/C10H13NO2.ClH/c1-7-3-4-8(6-11)5-9(7)10(12)13-2;/h3-5H,6,11H2,1-2H3;1H

Composition: C (55.69%), H (6.54%), Cl (16.44%), N (6.49%), O (14.84%)

Molar Mass: 215.68

Atom Count: 28

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	215.0713064
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	VYROWNPNIKURGC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.6
Topological Polar Surface Area	52.32
Polarizability	19.87
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<2 Days	2153472-90-1		$201.25-$4,597.70$201.25$286.35$457.70$687.70$1,147.70$4,597.70