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4-bromo-3-phenyl-1H-pyrazole

4-bromo-3-phenyl-1H-pyrazole

CAS: 13808-65-6

Formula: C9H7BrN2

SMILES: BrC1=CNN=C1C1=CC=CC=C1

IUPAC: 4-bromo-3-phenyl-1H-pyrazole

InChI: InChI=1S/C9H7BrN2/c10-8-6-11-12-9(8)7-4-2-1-3-5-7/h1-6H,(H,11,12)

Composition: C (48.46%), H (3.16%), Br (35.82%), N (12.56%)

Molar Mass: 223.073

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 221.979261
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey ZJFUSLGMGSYTRY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.13
Topological Polar Surface Area 28.68
Polarizability 20.78
Ring Count 2
Rotatable Bond Count 1

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98% <7 Days 13808-65-6 $7.25-$266.00$7.25$8.28$17.60$63.14$123.17$266.00
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98% <6 Days 13808-65-6 $5.75-$288.65$5.75$8.05$18.40$82.80$288.65
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97% <5 Days 13808-65-6 $610.00-$775.00$610.00$775.00
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