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32462-78-5 | N*1*-Ethyl-N*1*-(4-methoxy-benzyl)-ethane-1,2-diamine
CAS No: 32462-78-5 Catalog No: AG01F8C5 MDL No:
Product Description
Catalog Number:
AG01F8C5
Chemical Name:
N*1*-Ethyl-N*1*-(4-methoxy-benzyl)-ethane-1,2-diamine
CAS Number:
32462-78-5
Molecular Formula:
C12H20N2O
Molecular Weight:
208.3000
IUPAC Name:
N'-ethyl-N'-[(4-methoxyphenyl)methyl]ethane-1,2-diamine
InChI:
InChI=1S/C12H20N2O/c1-3-14(9-8-13)10-11-4-6-12(15-2)7-5-11/h4-7H,3,8-10,13H2,1-2H3
InChI Key:
NGEVOIHRMKJPNZ-UHFFFAOYSA-N
SMILES:
NCCN(Cc1ccc(cc1)OC)CC
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.158g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.305g/mol
Monoisotopic Mass:
208.158g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
38.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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