methyl 3-(4-fluoro-3-nitrophenyl)propanoate

methyl 3-(4-fluoro-3-nitrophenyl)propanoate

CAS: 907602-44-2

Formula: C10H10FNO4

SMILES: COC(=O)CCC1=CC=C(F)C(=C1)[N+]([O-])=O

IUPAC: methyl 3-(4-fluoro-3-nitrophenyl)propanoate

InChI: InChI=1S/C10H10FNO4/c1-16-10(13)5-3-7-2-4-8(11)9(6-7)12(14)15/h2,4,6H,3,5H2,1H3

Composition: C (52.87%), H (4.44%), F (8.36%), N (6.17%), O (28.17%)

Molar Mass: 227.191

Atom Count: 26

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	227.059385969
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	BBYSSQZSIUKMFI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.27
Topological Polar Surface Area	69.44
Polarizability	20.16
Ring Count	1
Rotatable Bond Count	5

Suppliers

J&W PHARMLAB LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<2 Days	907602-44-2		$165.60-$3,447.70$165.60$216.20$316.25$516.35$917.70$3,447.70