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119-94-8 | Benzenemethanamine, N-ethyl-N-(3-methylphenyl)-
CAS No: 119-94-8 Catalog No: AG000P0S MDL No:MFCD00025950
Product Description
Catalog Number:
AG000P0S
Chemical Name:
Benzenemethanamine, N-ethyl-N-(3-methylphenyl)-
CAS Number:
119-94-8
Molecular Formula:
C16H19N
Molecular Weight:
225.3288
MDL Number:
MFCD00025950
IUPAC Name:
N-benzyl-N-ethyl-3-methylaniline
InChI:
InChI=1S/C16H19N/c1-3-17(13-15-9-5-4-6-10-15)16-11-7-8-14(2)12-16/h4-12H,3,13H2,1-2H3
InChI Key:
VIACAIAQHPLINF-UHFFFAOYSA-N
SMILES:
CCN(c1cccc(c1)C)Cc1ccccc1
EC Number:
204-359-6
UNII:
LK3LC8CT3L
NSC Number:
8089
UN Number:
2753
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.152g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.335g/mol
Monoisotopic Mass:
225.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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