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20817-05-4 | Phenol, 3,3'-oxybis[6-amino-
CAS No: 20817-05-4 Catalog No: AG002JIV MDL No:MFCD23135461
Product Description
Catalog Number:
AG002JIV
Chemical Name:
Phenol, 3,3'-oxybis[6-amino-
CAS Number:
20817-05-4
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
MDL Number:
MFCD23135461
IUPAC Name:
2-amino-5-(4-amino-3-hydroxyphenoxy)phenol
InChI:
InChI=1S/C12H12N2O3/c13-9-3-1-7(5-11(9)15)17-8-2-4-10(14)12(16)6-8/h1-6,15-16H,13-14H2
InChI Key:
FFXSDAGPJYALFE-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1O)Oc1ccc(c(c1)O)N
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
232.239g/mol
Monoisotopic Mass:
232.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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