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69271-40-5 | 3-Butyn-2-ol,4-(1H-benzimidazol-2-yl)-2-methyl-(9CI)
CAS No: 69271-40-5 Catalog No: AG00FN90 MDL No:
Product Description
Catalog Number:
AG00FN90
Chemical Name:
3-Butyn-2-ol,4-(1H-benzimidazol-2-yl)-2-methyl-(9CI)
CAS Number:
69271-40-5
IUPAC Name:
4-(1H-benzimidazol-2-yl)-2-methylbut-3-yn-2-ol
InChI:
InChI=1S/C12H12N2O/c1-12(2,15)8-7-11-13-9-5-3-4-6-10(9)14-11/h3-6,15H,1-2H3,(H,13,14)
InChI Key:
QDRWKDPQJNPHBZ-UHFFFAOYSA-N
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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