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6451-26-9 | 3-(3-Methoxyphenoxy);propan-1-amine
CAS No: 6451-26-9 Catalog No: AG003I2G MDL No:MFCD07788402
Product Description
Catalog Number:
AG003I2G
Chemical Name:
3-(3-Methoxyphenoxy);propan-1-amine
CAS Number:
6451-26-9
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
MDL Number:
MFCD07788402
IUPAC Name:
3-(3-methoxyphenoxy)propan-1-amine
InChI:
InChI=1S/C10H15NO2/c1-12-9-4-2-5-10(8-9)13-7-3-6-11/h2,4-5,8H,3,6-7,11H2,1H3
InChI Key:
KZLHWRUQUSVISJ-UHFFFAOYSA-N
SMILES:
NCCCOc1cccc(c1)OC
Properties
Complexity:
130
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:
5
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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