AI05117
100948-84-3 | 1,2-dichloro-4-methoxy-5-nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AI05117
ChemicalName
1,2-dichloro-4-methoxy-5-nitrobenzene
CasNumber
100948-84-3
MolecularFormula
C7H5Cl2NO3
MolecularWeight
222.0255
MdlNumber
MFCD28787077
Smiles
COc1cc(Cl)c(cc1[N+](=O)[O-])Cl
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.8
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CatalogNumber: AI05117
ChemicalName: 1,2-dichloro-4-methoxy-5-nitrobenzene
CasNumber: 100948-84-3
MolecularFormula: C7H5Cl2NO3
MolecularWeight: 222.0255
MdlNumber: MFCD28787077
Smiles: COc1cc(Cl)c(cc1[N+](=O)[O-])Cl
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AI05117
ChemicalName:
1,2-dichloro-4-methoxy-5-nitrobenzene
CasNumber:
100948-84-3
MolecularFormula:
C7H5Cl2NO3
MolecularWeight:
222.0255
MdlNumber:
MFCD28787077
Smiles:
COc1cc(Cl)c(cc1[N+](=O)[O-])Cl
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.8
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Smiles: NNC(=O)C1CCCN1S(=O)(=O)c1ccc2c(c1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
NNC(=O)C1CCCN1S(=O)(=O)c1ccc2c(c1)cccc2
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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Smiles: OC(=O)C(N(S(=O)(=O)C)c1ccc(c(c1)C)C)C
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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Smiles:
OC(=O)C(N(S(=O)(=O)C)c1ccc(c(c1)C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: N#Cc1ccc(cc1)NC(=O)Nc1ccc(cc1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1ccc(cc1)NC(=O)Nc1ccc(cc1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__