AI59087
882679-89-2 | 2-Fluoro-3-iodo-4-methylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI59087
ChemicalName
2-Fluoro-3-iodo-4-methylbenzoic acid
CasNumber
882679-89-2
MolecularFormula
C8H6FIO2
MolecularWeight
280.0349132
MdlNumber
MFCD20485146
Smiles
OC(=O)c1ccc(c(c1F)I)C
Complexity
186
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.6
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CatalogNumber: AI59087
ChemicalName: 2-Fluoro-3-iodo-4-methylbenzoic acid
CasNumber: 882679-89-2
MolecularFormula: C8H6FIO2
MolecularWeight: 280.0349132
MdlNumber: MFCD20485146
Smiles: OC(=O)c1ccc(c(c1F)I)C
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AI59087
ChemicalName:
2-Fluoro-3-iodo-4-methylbenzoic acid
CasNumber:
882679-89-2
MolecularFormula:
C8H6FIO2
MolecularWeight:
280.0349132
MdlNumber:
MFCD20485146
Smiles:
OC(=O)c1ccc(c(c1F)I)C
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.6
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MolecularFormula: __
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Smiles: Cc1nc(nc(c1)C)N1CCNCC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Cc1nc(nc(c1)C)N1CCNCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: Clc1ncnc(c1N)N1CCCc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
Clc1ncnc(c1N)N1CCCc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cccc2c1[nH]cc2C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccc2c1[nH]cc2C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__