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200281-28-3 | Benzenemethanamine, 5-amino-2-ethyl-
CAS No: 200281-28-3 Catalog No: AG002CN1 MDL No:
Product Description
Catalog Number:
AG002CN1
Chemical Name:
Benzenemethanamine, 5-amino-2-ethyl-
CAS Number:
200281-28-3
Molecular Formula:
C9H14N2
Molecular Weight:
150.2209
IUPAC Name:
3-(aminomethyl)-4-ethylaniline
InChI:
InChI=1S/C9H14N2/c1-2-7-3-4-9(11)5-8(7)6-10/h3-5H,2,6,10-11H2,1H3
InChI Key:
JTKLWLKATVDILB-UHFFFAOYSA-N
SMILES:
NCc1cc(N)ccc1CC
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.116g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
150.225g/mol
Monoisotopic Mass:
150.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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