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824428-29-7 | 1H-Benzimidazole, 1-(diethoxymethyl)-5-methoxy-
CAS No: 824428-29-7 Catalog No: AG00512Z MDL No:
Product Description
Catalog Number:
AG00512Z
Chemical Name:
1H-Benzimidazole, 1-(diethoxymethyl)-5-methoxy-
CAS Number:
824428-29-7
Molecular Formula:
C13H18N2O3
Molecular Weight:
250.2936
IUPAC Name:
1-(diethoxymethyl)-5-methoxybenzimidazole
InChI:
InChI=1S/C13H18N2O3/c1-4-17-13(18-5-2)15-9-14-11-8-10(16-3)6-7-12(11)15/h6-9,13H,4-5H2,1-3H3
InChI Key:
PXJQZHLJTGEFHU-UHFFFAOYSA-N
SMILES:
CCOC(n1cnc2c1ccc(c2)OC)OCC
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.298g/mol
Monoisotopic Mass:
250.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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