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119290-83-4 | Benzenemethanamine, N-cyclopropyl-4-(1,1-dimethylethyl)-
CAS No: 119290-83-4 Catalog No: AG000IIM MDL No:MFCD09045000
Product Description
Catalog Number:
AG000IIM
Chemical Name:
Benzenemethanamine, N-cyclopropyl-4-(1,1-dimethylethyl)-
CAS Number:
119290-83-4
Molecular Formula:
C14H21N
Molecular Weight:
203.3232
MDL Number:
MFCD09045000
IUPAC Name:
N-[(4-tert-butylphenyl)methyl]cyclopropanamine
InChI:
InChI=1S/C14H21N/c1-14(2,3)12-6-4-11(5-7-12)10-15-13-8-9-13/h4-7,13,15H,8-10H2,1-3H3
InChI Key:
WOEIDUGAOYDNPF-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)CNC1CC1)(C)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.167g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.329g/mol
Monoisotopic Mass:
203.167g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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