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140715-61-3 | Benzenemethanamine, N-ethyl-3-methoxy-
CAS No: 140715-61-3 Catalog No: AG001CQA MDL No:MFCD07405846
Product Description
Catalog Number:
AG001CQA
Chemical Name:
Benzenemethanamine, N-ethyl-3-methoxy-
CAS Number:
140715-61-3
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
MDL Number:
MFCD07405846
IUPAC Name:
N-[(3-methoxyphenyl)methyl]ethanamine
InChI:
InChI=1S/C10H15NO/c1-3-11-8-9-5-4-6-10(7-9)12-2/h4-7,11H,3,8H2,1-2H3
InChI Key:
UJJCCNDLJXEMPR-UHFFFAOYSA-N
SMILES:
CCNCc1cccc(c1)OC
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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