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86723-15-1 | 1,2-Benzenediamine, 4,5-dipropoxy-
CAS No: 86723-15-1 Catalog No: AG004T22 MDL No:
Product Description
Catalog Number:
AG004T22
Chemical Name:
1,2-Benzenediamine, 4,5-dipropoxy-
CAS Number:
86723-15-1
Molecular Formula:
C12H20N2O2
Molecular Weight:
224.2994
IUPAC Name:
4,5-dipropoxybenzene-1,2-diamine
InChI:
InChI=1S/C12H20N2O2/c1-3-5-15-11-7-9(13)10(14)8-12(11)16-6-4-2/h7-8H,3-6,13-14H2,1-2H3
InChI Key:
PXDISLFCPBLGPP-UHFFFAOYSA-N
SMILES:
CCCOc1cc(N)c(cc1OCCC)N
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.152g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.304g/mol
Monoisotopic Mass:
224.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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