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Home > Imidazoles > 77501-18-9
77501-18-9 | 4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)-4-HEPTANOL
CAS No: 77501-18-9 Catalog No: AG0059BQ MDL No:
Product Description
Catalog Number:
AG0059BQ
Chemical Name:
4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)-4-HEPTANOL
CAS Number:
77501-18-9
Molecular Formula:
C10H20N2O
Molecular Weight:
184.2786
IUPAC Name:
4-(4,5-dihydro-1H-imidazol-2-yl)heptan-4-ol
InChI:
InChI=1S/C10H20N2O/c1-3-5-10(13,6-4-2)9-11-7-8-12-9/h13H,3-8H2,1-2H3,(H,11,12)
InChI Key:
RNAFLVREEUYBFD-UHFFFAOYSA-N
SMILES:
CCCC(C1=NCCN1)(CCC)O
UNII:
NN620V5C4Y
NSC Number:
356707
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.158g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.283g/mol
Monoisotopic Mass:
184.158g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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