AI65783
98968-66-2 | Methyl 3-amino-2,4-dichlorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AI65783
ChemicalName
Methyl 3-amino-2,4-dichlorobenzoate
CasNumber
98968-66-2
MolecularFormula
C8H7Cl2NO2
MolecularWeight
220.0527
MdlNumber
MFCD27935902
Smiles
COC(=O)c1ccc(c(c1Cl)N)Cl
Complexity
201
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AI65783
ChemicalName: Methyl 3-amino-2,4-dichlorobenzoate
CasNumber: 98968-66-2
MolecularFormula: C8H7Cl2NO2
MolecularWeight: 220.0527
MdlNumber: MFCD27935902
Smiles: COC(=O)c1ccc(c(c1Cl)N)Cl
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AI65783
ChemicalName:
Methyl 3-amino-2,4-dichlorobenzoate
CasNumber:
98968-66-2
MolecularFormula:
C8H7Cl2NO2
MolecularWeight:
220.0527
MdlNumber:
MFCD27935902
Smiles:
COC(=O)c1ccc(c(c1Cl)N)Cl
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)Nc1ccccc1F
Complexity: 225
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=C(OC(C)(C)C)Nc1ccccc1F
Complexity:
225
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
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Smiles: Clc1cc(cnc1Oc1ccccc1N)C(F)(F)F
Complexity: __
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Smiles:
Clc1cc(cnc1Oc1ccccc1N)C(F)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CCOC(=O)C1CN(CCCC1=O)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C1CN(CCCC1=O)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__