AH19594
71856-54-7 | 5-Amino-1-(2-bromophenyl)-1h-pyrazole-4-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AH19594
ChemicalName
5-Amino-1-(2-bromophenyl)-1h-pyrazole-4-carbonitrile
CasNumber
71856-54-7
MolecularFormula
C10H7BrN4
MolecularWeight
263.0934
MdlNumber
MFCD03407394
Smiles
N#Cc1cnn(c1N)c1ccccc1Br
Complexity
274
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.5
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CatalogNumber: AH19594
ChemicalName: 5-Amino-1-(2-bromophenyl)-1h-pyrazole-4-carbonitrile
CasNumber: 71856-54-7
MolecularFormula: C10H7BrN4
MolecularWeight: 263.0934
MdlNumber: MFCD03407394
Smiles: N#Cc1cnn(c1N)c1ccccc1Br
Complexity: 274
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AH19594
ChemicalName:
5-Amino-1-(2-bromophenyl)-1h-pyrazole-4-carbonitrile
CasNumber:
71856-54-7
MolecularFormula:
C10H7BrN4
MolecularWeight:
263.0934
MdlNumber:
MFCD03407394
Smiles:
N#Cc1cnn(c1N)c1ccccc1Br
Complexity:
274
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.5
CatalogNumber: AH19595
ChemicalName: Methyl 2-bromo-5-iodobenzoate
CasNumber: 717880-58-5
MolecularFormula: C8H6BrIO2
MolecularWeight: 340.94051
MdlNumber: MFCD01851253
Smiles: COC(=O)c1cc(I)ccc1Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AH19595
ChemicalName:
Methyl 2-bromo-5-iodobenzoate
CasNumber:
717880-58-5
MolecularFormula:
C8H6BrIO2
MolecularWeight:
340.94051
MdlNumber:
MFCD01851253
Smiles:
COC(=O)c1cc(I)ccc1Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(NN=Cc1ccccc1O)N/N=C/c1ccccc1O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(NN=Cc1ccccc1O)N/N=C/c1ccccc1O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCNCC(O)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCNCC(O)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__