4-amino-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylic acid

4-amino-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylic acid

CAS: 123654-26-2

Formula: C9H8ClNO3

SMILES: NC1=C(Cl)C=C(C(O)=O)C2=C1CCO2

IUPAC: 4-amino-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylic acid

InChI: InChI=1S/C9H8ClNO3/c10-6-3-5(9(12)13)8-4(7(6)11)1-2-14-8/h3H,1-2,11H2,(H,12,13)

Composition: C (50.60%), H (3.77%), Cl (16.60%), N (6.56%), O (22.47%)

Molar Mass: 213.62

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	213.0192708
Formal Charge	0
FSP3	0.22
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	KRMUVKSAOVLXLF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.59
Topological Polar Surface Area	72.55
Polarizability	19.34
Ring Count	2
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	123654-26-2		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	123654-26-2		$7.25-$271.17$7.25$8.28$15.53$65.21$125.24$271.17

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<6 Days	123654-26-2		$6.90-$88.55$6.90$20.70$88.55

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	123654-26-2		$8.83-$98.36$8.83$11.35$29.00$98.36

CLEARSYNTH LABS

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<14 Days	123654-26-2		$109.14-$525.30$109.14$176.46$525.30