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51390-23-9 | 1-(3-HYDROXYPROPYL)-1H-IMIDAZOLE
CAS No: 51390-23-9 Catalog No: AG00DAMU MDL No:MFCD03727256
Product Description
Catalog Number:
AG00DAMU
Chemical Name:
1-(3-HYDROXYPROPYL)-1H-IMIDAZOLE
CAS Number:
51390-23-9
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
MDL Number:
MFCD03727256
IUPAC Name:
3-imidazol-1-ylpropan-1-ol
InChI:
InChI=1S/C6H10N2O/c9-5-1-3-8-4-2-7-6-8/h2,4,6,9H,1,3,5H2
InChI Key:
RYZVYLGJZFNBND-UHFFFAOYSA-N
SMILES:
OCCCn1cncc1
Properties
Complexity:
77.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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