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Home > Imidazoles > 80304-48-9
80304-48-9 | (1-CYCLOHEXYL-1H-IMIDAZOL-5-YL)METHANOL
CAS No: 80304-48-9 Catalog No: AG005BR8 MDL No:MFCD08060036
Product Description
Catalog Number:
AG005BR8
Chemical Name:
(1-CYCLOHEXYL-1H-IMIDAZOL-5-YL)METHANOL
CAS Number:
80304-48-9
Molecular Formula:
C10H16N2O
Molecular Weight:
180.2468
MDL Number:
MFCD08060036
IUPAC Name:
(3-cyclohexylimidazol-4-yl)methanol
InChI:
InChI=1S/C10H16N2O/c13-7-10-6-11-8-12(10)9-4-2-1-3-5-9/h6,8-9,13H,1-5,7H2
InChI Key:
WLUAESWSQMVJSC-UHFFFAOYSA-N
SMILES:
OCc1cncn1C1CCCCC1
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.251g/mol
Monoisotopic Mass:
180.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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