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229486-99-1 | Benzenemethanamine, 2,5-dimethoxy-N-methyl-
CAS No: 229486-99-1 Catalog No: AG002LMF MDL No:MFCD09732253
Product Description
Catalog Number:
AG002LMF
Chemical Name:
Benzenemethanamine, 2,5-dimethoxy-N-methyl-
CAS Number:
229486-99-1
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
MDL Number:
MFCD09732253
IUPAC Name:
1-(2,5-dimethoxyphenyl)-N-methylmethanamine
InChI:
InChI=1S/C10H15NO2/c1-11-7-8-6-9(12-2)4-5-10(8)13-3/h4-6,11H,7H2,1-3H3
InChI Key:
HRHKLVYTRSJMSG-UHFFFAOYSA-N
SMILES:
CNCc1cc(OC)ccc1OC
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.11g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.235g/mol
Monoisotopic Mass:
181.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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