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477762-43-9 | 2-[(1E)-[2-(quinolin-8-yl)hydrazin-1-ylidene]methyl]phenol hydrochloride
CAS No: 477762-43-9 Catalog No: AG00IR3F MDL No:MFCD06795625
Product Description
Catalog Number:
AG00IR3F
Chemical Name:
2-[(1E)-[2-(quinolin-8-yl)hydrazin-1-ylidene]methyl]phenol hydrochloride
CAS Number:
477762-43-9
Molecular Formula:
C16H14ClN3O
Molecular Weight:
299.7549
MDL Number:
MFCD06795625
IUPAC Name:
2-[(E)-(quinolin-1-ium-8-ylhydrazinylidene)methyl]phenol;chloride
InChI:
InChI=1S/C16H13N3O.ClH/c20-15-9-2-1-5-13(15)11-18-19-14-8-3-6-12-7-4-10-17-16(12)14;/h1-11,19-20H;1H/b18-11+;
InChI Key:
IMCNYJGVILQWQN-NWBUNABESA-N
SMILES:
Oc1ccccc1/C=N/Nc1cccc2c1[nH+]ccc2.[Cl-]
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
299.083g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
299.758g/mol
Monoisotopic Mass:
299.083g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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