methyl 5-[(2-chloroacetamido)methyl]furan-2-carboxylate

methyl 5-[(2-chloroacetamido)methyl]furan-2-carboxylate

CAS: 345991-81-3

Formula: C9H10ClNO4

SMILES: COC(=O)C1=CC=C(CNC(=O)CCl)O1

IUPAC: methyl 5-[(2-chloroacetamido)methyl]furan-2-carboxylate

InChI: InChI=1S/C9H10ClNO4/c1-14-9(13)7-3-2-6(15-7)5-11-8(12)4-10/h2-3H,4-5H2,1H3,(H,11,12)

Composition: C (46.67%), H (4.35%), Cl (15.30%), N (6.05%), O (27.63%)

Molar Mass: 231.63

Atom Count: 25

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	231.0298355
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	GCUIIZROYFZOCF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.02
Topological Polar Surface Area	68.54
Polarizability	20.38
Ring Count	1
Rotatable Bond Count	5

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90%	<2 Days	345991-81-3		$51.35-$1,250.91$51.35$63.37$86.31$262.20$381.28$1,250.91

ChemBridge Corp.

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