AA07595
101937-44-4 | Diethyl 2-(((4-bromophenyl)amino)methylene)malonate
Manufacturer: A2B Chem
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CatalogNumber
AA07595
ChemicalName
Diethyl 2-(((4-bromophenyl)amino)methylene)malonate
CasNumber
101937-44-4
MolecularFormula
C14H16BrNO4
MolecularWeight
342.1851
MdlNumber
MFCD00173358
Smiles
CCOC(=O)C(=CNc1ccc(cc1)Br)C(=O)OCC
Complexity
342
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
8
Xlogp3
3.9
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CatalogNumber: AA07595
ChemicalName: Diethyl 2-(((4-bromophenyl)amino)methylene)malonate
CasNumber: 101937-44-4
MolecularFormula: C14H16BrNO4
MolecularWeight: 342.1851
MdlNumber: MFCD00173358
Smiles: CCOC(=O)C(=CNc1ccc(cc1)Br)C(=O)OCC
Complexity: 342
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 8
Xlogp3: 3.9
CatalogNumber:
AA07595
ChemicalName:
Diethyl 2-(((4-bromophenyl)amino)methylene)malonate
CasNumber:
101937-44-4
MolecularFormula:
C14H16BrNO4
MolecularWeight:
342.1851
MdlNumber:
MFCD00173358
Smiles:
CCOC(=O)C(=CNc1ccc(cc1)Br)C(=O)OCC
Complexity:
342
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
8
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(Oc1cccc2c1cccc2)C=Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(Oc1cccc2c1cccc2)C=Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cccc(c1Br)O
Complexity: 158
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cccc(c1Br)O
Complexity:
158
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)NNC(=O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)NNC(=O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__