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Home Halogens (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol

(2-Butyl-4-chloro-1H-imidazol-5-yl)methanol

CAS No.:
79047-41-9
Catalog Number:
AG003BME
Molecular Formula:
C8H13ClN2O
Molecular Weight:
188.6546
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$205
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Product Description
Catalog Number:
AG003BME
Chemical Name:
(2-Butyl-4-chloro-1H-imidazol-5-yl)methanol
CAS Number:
79047-41-9
Molecular Formula:
C8H13ClN2O
Molecular Weight:
188.6546
MDL Number:
MFCD01934397
IUPAC Name:
(2-butyl-4-chloro-1H-imidazol-5-yl)methanol
InChI:
InChI=1S/C8H13ClN2O/c1-2-3-4-7-10-6(5-12)8(9)11-7/h12H,2-5H2,1H3,(H,10,11)
InChI Key:
DXSZKDOOHOBZMT-UHFFFAOYSA-N
SMILES:
CCCCc1nc(c([nH]1)CO)Cl
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.072g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
188.655g/mol
Monoisotopic Mass:
188.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
New method for the synthesis of diversely functionalized imidazoles from N-acylated alpha-aminonitriles. Organic letters 20040318
Properties