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1344092-28-9 | 4-iodo-1-(oxolan-3-yl)-1H-pyrazole
CAS No: 1344092-28-9 Catalog No: AG00HTBJ MDL No:MFCD20327535
Product Description
Catalog Number:
AG00HTBJ
Chemical Name:
4-iodo-1-(oxolan-3-yl)-1H-pyrazole
CAS Number:
1344092-28-9
Molecular Formula:
C7H9IN2O
Molecular Weight:
264.0636
MDL Number:
MFCD20327535
IUPAC Name:
4-iodo-1-(oxolan-3-yl)pyrazole
InChI:
InChI=1S/C7H9IN2O/c8-6-3-9-10(4-6)7-1-2-11-5-7/h3-4,7H,1-2,5H2
InChI Key:
DKGHBEPVXFLEIB-UHFFFAOYSA-N
SMILES:
Ic1cnn(c1)C1COCC1
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.976g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.066g/mol
Monoisotopic Mass:
263.976g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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