benzyl N-{[methoxy(methyl)carbamoyl]methyl}carbamate

benzyl N-{[methoxy(methyl)carbamoyl]methyl}carbamate

CAS: 121505-94-0

Formula: C12H16N2O4

SMILES: CON(C)C(=O)CNC(=O)OCC1=CC=CC=C1

IUPAC: benzyl N-{[methoxy(methyl)carbamoyl]methyl}carbamate

InChI: InChI=1S/C12H16N2O4/c1-14(17-2)11(15)8-13-12(16)18-9-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,13,16)

Composition: C (57.13%), H (6.39%), N (11.10%), O (25.37%)

Molar Mass: 252.27

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	252.111007003
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NWYPLKICSHBTAJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.65
Topological Polar Surface Area	67.87
Polarizability	25.23
Ring Count	1
Rotatable Bond Count	6

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