AI28897
1279202-08-2 | 3-(3-Fluorophenyl)-4H-1,2,4-triazole
Manufacturer: A2B Chem
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CatalogNumber
AI28897
ChemicalName
3-(3-Fluorophenyl)-4H-1,2,4-triazole
CasNumber
1279202-08-2
MolecularFormula
C8H6FN3
MolecularWeight
163.1517
MdlNumber
MFCD18784762
Smiles
Fc1cccc(c1)c1n[nH]cn1
Complexity
153
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.7
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CatalogNumber: AI28897
ChemicalName: 3-(3-Fluorophenyl)-4H-1,2,4-triazole
CasNumber: 1279202-08-2
MolecularFormula: C8H6FN3
MolecularWeight: 163.1517
MdlNumber: MFCD18784762
Smiles: Fc1cccc(c1)c1n[nH]cn1
Complexity: 153
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AI28897
ChemicalName:
3-(3-Fluorophenyl)-4H-1,2,4-triazole
CasNumber:
1279202-08-2
MolecularFormula:
C8H6FN3
MolecularWeight:
163.1517
MdlNumber:
MFCD18784762
Smiles:
Fc1cccc(c1)c1n[nH]cn1
Complexity:
153
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.7
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MolecularFormula: __
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Smiles: COC(=O)c1cc(O)c2c(c1)occ2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(=O)c1cc(O)c2c(c1)occ2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: OC(=O)c1ccccc1c1n[nH]c(n1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccccc1c1n[nH]c(n1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)Cc1nc(=N)[nH][nH]1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cc1nc(=N)[nH][nH]1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__