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1012880-01-1 | 1H-Pyrazole, 4-bromo-1-cyclopentyl-
CAS No: 1012880-01-1 Catalog No: AG00044X MDL No:MFCD12824331
Product Description
Catalog Number:
AG00044X
Chemical Name:
1H-Pyrazole, 4-bromo-1-cyclopentyl-
CAS Number:
1012880-01-1
Molecular Formula:
C8H11BrN2
Molecular Weight:
215.0903
MDL Number:
MFCD12824331
IUPAC Name:
4-bromo-1-cyclopentylpyrazole
InChI:
InChI=1S/C8H11BrN2/c9-7-5-10-11(6-7)8-3-1-2-4-8/h5-6,8H,1-4H2
InChI Key:
DDMLTVXCHRGCFK-UHFFFAOYSA-N
SMILES:
Brc1cnn(c1)C1CCCC1
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.011g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.094g/mol
Monoisotopic Mass:
214.011g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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