AB76884
81112-08-5 | N-[4-(2-Chloropropanoyl)phenyl]acetamide
Manufacturer: A2B Chem
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CatalogNumber
AB76884
ChemicalName
N-[4-(2-Chloropropanoyl)phenyl]acetamide
CasNumber
81112-08-5
MolecularFormula
C11H12ClNO2
MolecularWeight
225.67148000000003
MdlNumber
MFCD06364488
Smiles
CC(=O)Nc1ccc(cc1)C(=O)C(Cl)C
NscNumber
281614
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
2.3
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CatalogNumber: AB76884
ChemicalName: N-[4-(2-Chloropropanoyl)phenyl]acetamide
CasNumber: 81112-08-5
MolecularFormula: C11H12ClNO2
MolecularWeight: 225.67148000000003
MdlNumber: MFCD06364488
Smiles: CC(=O)Nc1ccc(cc1)C(=O)C(Cl)C
NscNumber: 281614
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.3
CatalogNumber:
AB76884
ChemicalName:
N-[4-(2-Chloropropanoyl)phenyl]acetamide
CasNumber:
81112-08-5
MolecularFormula:
C11H12ClNO2
MolecularWeight:
225.67148000000003
MdlNumber:
MFCD06364488
Smiles:
CC(=O)Nc1ccc(cc1)C(=O)C(Cl)C
NscNumber:
281614
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1cc(Cc2ccccc2C(C)C)c(c(c1O)O)O)Nc1ccc(cc1)S(=O)(=O)c1ccccc1C(C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1cc(Cc2ccccc2C(C)C)c(c(c1O)O)O)Nc1ccc(cc1)S(=O)(=O)c1ccccc1C(C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(ON1C(=O)CCC1=O)OCc1ccc(cc1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(ON1C(=O)CCC1=O)OCc1ccc(cc1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB76888
ChemicalName: N-[4-(3-Aminophenyl)-2-thiazolyl]acetamide
CasNumber: 134812-30-9
MolecularFormula: C11H11N3OS
MolecularWeight: 233.2895
MdlNumber: MFCD01114798
Smiles: CC(=O)Nc1scc(n1)c1cccc(c1)N
NscNumber: __
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 1.4
CatalogNumber:
AB76888
ChemicalName:
N-[4-(3-Aminophenyl)-2-thiazolyl]acetamide
CasNumber:
134812-30-9
MolecularFormula:
C11H11N3OS
MolecularWeight:
233.2895
MdlNumber:
MFCD01114798
Smiles:
CC(=O)Nc1scc(n1)c1cccc(c1)N
NscNumber:
__
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.4