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tert-butyl N-(2-formylphenyl)carbamate

tert-butyl N-(2-formylphenyl)carbamate

CAS: 74965-38-1

Formula: C12H15NO3

SMILES: CC(C)(C)OC(=O)NC1=CC=CC=C1C=O

IUPAC: tert-butyl N-(2-formylphenyl)carbamate

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