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1-(4-tert-butylphenyl)methanamine

1-(4-tert-butylphenyl)methanamine

CAS: 39895-55-1

Formula: C11H17N

SMILES: CC(C)(C)C1=CC=C(CN)C=C1

IUPAC: 1-(4-tert-butylphenyl)methanamine

InChI: InChI=1S/C11H17N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,8,12H2,1-3H3

Composition: C (80.92%), H (10.50%), N (8.58%)

Molar Mass: 163.264

Atom Count: 29

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 163.136099551
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey MPWSRGAWRAYBJK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.2
Topological Polar Surface Area 26.02
Polarizability 21.05
Ring Count 1
Rotatable Bond Count 2

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