tert-butyl N-(2-acetyl-4-tert-butylphenyl)carbamate

tert-butyl N-(2-acetyl-4-tert-butylphenyl)carbamate

CAS: 2680797-22-0

Formula: C17H25NO3

SMILES: CC(=O)C1=CC(=CC=C1NC(=O)OC(C)(C)C)C(C)(C)C

IUPAC: tert-butyl N-(2-acetyl-4-tert-butylphenyl)carbamate

InChI: InChI=1S/C17H25NO3/c1-11(19)13-10-12(16(2,3)4)8-9-14(13)18-15(20)21-17(5,6)7/h8-10H,1-7H3,(H,18,20)

Composition: C (70.07%), H (8.65%), N (4.81%), O (16.47%)

Molar Mass: 291.391

Atom Count: 46

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	291.183443669
Formal Charge	0
FSP3	0.53
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RIHKBSOQSCWDHL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.42
Topological Polar Surface Area	55.4
Polarizability	32.44
Ring Count	1
Rotatable Bond Count	5

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