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64481-42-1 | Propanedial, (1,3-dihydro-2H-benzimidazol-2-ylidene)- (9CI)
CAS No: 64481-42-1 Catalog No: AG00F6YX MDL No:
Product Description
Catalog Number:
AG00F6YX
Chemical Name:
Propanedial, (1,3-dihydro-2H-benzimidazol-2-ylidene)- (9CI)
CAS Number:
64481-42-1
IUPAC Name:
(Z)-2-(1H-benzimidazol-2-yl)-3-hydroxyprop-2-enal
InChI:
InChI=1S/C10H8N2O2/c13-5-7(6-14)10-11-8-3-1-2-4-9(8)12-10/h1-6,13H,(H,11,12)/b7-5+
InChI Key:
KLDPXFHGAQCSGF-FNORWQNLSA-N
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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