3-methylbutyl N-[2-(furan-2-yl)ethylidene]carbamate

3-methylbutyl N-[2-(furan-2-yl)ethylidene]carbamate

CAS: 338399-65-8

Formula: C12H17NO3

SMILES: CC(C)CCOC(=O)N=CCC1=CC=CO1

IUPAC: 3-methylbutyl N-[2-(furan-2-yl)ethylidene]carbamate

InChI: InChI=1S/C12H17NO3/c1-10(2)6-9-16-12(14)13-7-5-11-4-3-8-15-11/h3-4,7-8,10H,5-6,9H2,1-2H3

Composition: C (64.55%), H (7.67%), N (6.27%), O (21.50%)

Molar Mass: 223.272

Atom Count: 33

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	223.120843411
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	SKLIFISOKLIMNX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.3
Topological Polar Surface Area	51.8
Polarizability	23.43
Ring Count	1
Rotatable Bond Count	6

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