tert-butyl N-(4-formylphenyl)carbamate

tert-butyl N-(4-formylphenyl)carbamate

CAS: 144072-30-0

Formula: C12H15NO3

SMILES: CC(C)(C)OC(=O)NC1=CC=C(C=O)C=C1

IUPAC: tert-butyl N-(4-formylphenyl)carbamate

InChI: InChI=1S/C12H15NO3/c1-12(2,3)16-11(15)13-10-6-4-9(8-14)5-7-10/h4-8H,1-3H3,(H,13,15)

Composition: C (65.14%), H (6.83%), N (6.33%), O (21.69%)

Molar Mass: 221.256

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	221.105193347
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SVQVBAUJEKSBEC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.93
Topological Polar Surface Area	55.4
Polarizability	23.33
Ring Count	1
Rotatable Bond Count	4

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