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36000-20-1 | 1H-Benzimidazole,2-[(methylthio)methyl]-(9CI)
CAS No: 36000-20-1 Catalog No: AG00CWO9 MDL No:
Product Description
Catalog Number:
AG00CWO9
Chemical Name:
1H-Benzimidazole,2-[(methylthio)methyl]-(9CI)
CAS Number:
36000-20-1
IUPAC Name:
2-(methoxymethyl)-1H-benzimidazole
InChI:
InChI=1S/C9H10N2O/c1-12-6-9-10-7-4-2-3-5-8(7)11-9/h2-5H,6H2,1H3,(H,10,11)
InChI Key:
PHBCKTTUXIONFQ-UHFFFAOYSA-N
NSC Number:
52070
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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