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53485-07-7 | N1-Methyl-N1-phenylpropane-1,3-diamine
CAS No: 53485-07-7 Catalog No: AG003SAM MDL No:MFCD00191602
Product Description
Catalog Number:
AG003SAM
Chemical Name:
N1-Methyl-N1-phenylpropane-1,3-diamine
CAS Number:
53485-07-7
Molecular Formula:
C10H16N2
Molecular Weight:
164.2474
MDL Number:
MFCD00191602
IUPAC Name:
N'-methyl-N'-phenylpropane-1,3-diamine
InChI:
InChI=1S/C10H16N2/c1-12(9-5-8-11)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9,11H2,1H3
InChI Key:
WGHBKYWUOOANEX-UHFFFAOYSA-N
SMILES:
NCCCN(c1ccccc1)C
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.252g/mol
Monoisotopic Mass:
164.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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