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17426-94-7 | Imidodicarbonimidic diamide, N-[2-(4-hydroxyphenyl)ethyl]-
CAS No: 17426-94-7 Catalog No: AG001ZJY MDL No:
Product Description
Catalog Number:
AG001ZJY
Chemical Name:
Imidodicarbonimidic diamide, N-[2-(4-hydroxyphenyl)ethyl]-
CAS Number:
17426-94-7
Molecular Formula:
C10H15N5O
Molecular Weight:
221.2590
IUPAC Name:
1-(diaminomethylidene)-2-[2-(4-hydroxyphenyl)ethyl]guanidine
InChI:
InChI=1S/C10H15N5O/c11-9(12)15-10(13)14-6-5-7-1-3-8(16)4-2-7/h1-4,16H,5-6H2,(H6,11,12,13,14,15)
InChI Key:
PQASMWYEXAKHKQ-UHFFFAOYSA-N
SMILES:
NC(=N)NC(=N)NCCc1ccc(cc1)O
UNII:
A1U54NH73S
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.128g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
221.264g/mol
Monoisotopic Mass:
221.128g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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