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10040-94-5 | 1-(3-methoxyphenyl)-1H-imidazole
CAS No: 10040-94-5 Catalog No: AG00KUTC MDL No:MFCD22273758
Product Description
Catalog Number:
AG00KUTC
Chemical Name:
1-(3-methoxyphenyl)-1H-imidazole
CAS Number:
10040-94-5
Molecular Formula:
C10H10N2O
Molecular Weight:
174.1992
MDL Number:
MFCD22273758
IUPAC Name:
1-(3-methoxyphenyl)imidazole
InChI:
InChI=1S/C10H10N2O/c1-13-10-4-2-3-9(7-10)12-6-5-11-8-12/h2-8H,1H3
InChI Key:
YZSKJBOVSBKCSY-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)n1cncc1
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.203g/mol
Monoisotopic Mass:
174.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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