ethyl N-(2-methyl-3-nitrophenyl)carbamate

ethyl N-(2-methyl-3-nitrophenyl)carbamate

CAS: 381670-28-6

Formula: C10H12N2O4

SMILES: CCOC(=O)NC1=C(C)C(=CC=C1)[N+]([O-])=O

IUPAC: ethyl N-(2-methyl-3-nitrophenyl)carbamate

InChI: InChI=1S/C10H12N2O4/c1-3-16-10(13)11-8-5-4-6-9(7(8)2)12(14)15/h4-6H,3H2,1-2H3,(H,11,13)

Composition: C (53.57%), H (5.39%), N (12.49%), O (28.54%)

Molar Mass: 224.216

Atom Count: 28

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	224.079706874
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	UTVICKYWFUXPCS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.65
Topological Polar Surface Area	81.47
Polarizability	21.45
Ring Count	1
Rotatable Bond Count	4

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