AA04291
101-92-8 | 4'-Chloroacetoacetanilide
Manufacturer: A2B Chem
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CatalogNumber
AA04291
ChemicalName
4'-Chloroacetoacetanilide
CasNumber
101-92-8
MolecularFormula
C10H10ClNO2
MolecularWeight
211.6449
MdlNumber
MFCD00000613
Smiles
O=C(Nc1ccc(cc1)Cl)CC(=O)C
NscNumber
3544
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AA04291
ChemicalName: 4'-Chloroacetoacetanilide
CasNumber: 101-92-8
MolecularFormula: C10H10ClNO2
MolecularWeight: 211.6449
MdlNumber: MFCD00000613
Smiles: O=C(Nc1ccc(cc1)Cl)CC(=O)C
NscNumber: 3544
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AA04291
ChemicalName:
4'-Chloroacetoacetanilide
CasNumber:
101-92-8
MolecularFormula:
C10H10ClNO2
MolecularWeight:
211.6449
MdlNumber:
MFCD00000613
Smiles:
O=C(Nc1ccc(cc1)Cl)CC(=O)C
NscNumber:
3544
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCCC(=O)Nc1ccc(cc1)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCCC(=O)Nc1ccc(cc1)O
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Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: O1CC1COc1cccc(c1)OCC1OC1
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Complexity: __
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HeavyAtomCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
O1CC1COc1cccc(c1)OCC1OC1
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]S(=O)(=O)O.N#[N+]c1ccc(cc1C)/N=N/c1ccccc1C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]S(=O)(=O)O.N#[N+]c1ccc(cc1C)/N=N/c1ccccc1C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__