AI38420
1642156-91-9 | 2-Chloro-5-fluoro-3-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI38420
ChemicalName
2-Chloro-5-fluoro-3-nitrobenzoic acid
CasNumber
1642156-91-9
MolecularFormula
C7H3ClFNO4
MolecularWeight
219.5544
MdlNumber
MFCD28752271
Smiles
Fc1cc([N+](=O)[O-])c(c(c1)C(=O)O)Cl
Complexity
257
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.8
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CatalogNumber: AI38420
ChemicalName: 2-Chloro-5-fluoro-3-nitrobenzoic acid
CasNumber: 1642156-91-9
MolecularFormula: C7H3ClFNO4
MolecularWeight: 219.5544
MdlNumber: MFCD28752271
Smiles: Fc1cc([N+](=O)[O-])c(c(c1)C(=O)O)Cl
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AI38420
ChemicalName:
2-Chloro-5-fluoro-3-nitrobenzoic acid
CasNumber:
1642156-91-9
MolecularFormula:
C7H3ClFNO4
MolecularWeight:
219.5544
MdlNumber:
MFCD28752271
Smiles:
Fc1cc([N+](=O)[O-])c(c(c1)C(=O)O)Cl
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FCC1CNC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
FCC1CNC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCSc1ccc(cc1N)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
CCSc1ccc(cc1N)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AI38423
ChemicalName: Erythrosin B, soldium salt
CasNumber: 16423-68-0
MolecularFormula: C20H6I4Na2O5
MolecularWeight: 879.8560600000003
MdlNumber: MFCD00144257
Smiles: O=C1OC2(c3c1cccc3)c1cc(I)c(c(c1Oc1c2cc(I)c(c1I)[O-])I)[O-].[Na+].[Na+]
Complexity: 645
Covalently-bondedUnitCount: 3
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AI38423
ChemicalName:
Erythrosin B, soldium salt
CasNumber:
16423-68-0
MolecularFormula:
C20H6I4Na2O5
MolecularWeight:
879.8560600000003
MdlNumber:
MFCD00144257
Smiles:
O=C1OC2(c3c1cccc3)c1cc(I)c(c(c1Oc1c2cc(I)c(c1I)[O-])I)[O-].[Na+].[Na+]
Complexity:
645
Covalently-bondedUnitCount:
3
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__