2-(3-amino-4-chlorobenzoyl)benzoic acid

2-(3-amino-4-chlorobenzoyl)benzoic acid

CAS: 118-04-7

Formula: C14H10ClNO3

SMILES: NC1=CC(=CC=C1Cl)C(=O)C1=CC=CC=C1C(O)=O

IUPAC: 2-(3-amino-4-chlorobenzoyl)benzoic acid

InChI: InChI=1S/C14H10ClNO3/c15-11-6-5-8(7-12(11)16)13(17)9-3-1-2-4-10(9)14(18)19/h1-7H,16H2,(H,18,19)

Composition: C (60.99%), H (3.66%), Cl (12.86%), N (5.08%), O (17.41%)

Molar Mass: 275.69

Atom Count: 29

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	275.0349209
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	MQECGSWGDQIHHD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.39
Topological Polar Surface Area	80.39
Polarizability	27.34
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	118-04-7		$10.35-$274.28$10.35$18.63$35.19$101.43$274.28

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<6 Days	118-04-7		$9.20-$227.70$9.20$12.65$227.70