AB44886
5798-75-4 | Ethyl 4-bromobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB44886
ChemicalName
Ethyl 4-bromobenzoate
CasNumber
5798-75-4
MolecularFormula
C9H9BrO2
MolecularWeight
229.0706
MdlNumber
MFCD00016329
Smiles
CCOC(=O)c1ccc(cc1)Br
NscNumber
67387
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
3.5
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CatalogNumber: AB44886
ChemicalName: Ethyl 4-bromobenzoate
CasNumber: 5798-75-4
MolecularFormula: C9H9BrO2
MolecularWeight: 229.0706
MdlNumber: MFCD00016329
Smiles: CCOC(=O)c1ccc(cc1)Br
NscNumber: 67387
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AB44886
ChemicalName:
Ethyl 4-bromobenzoate
CasNumber:
5798-75-4
MolecularFormula:
C9H9BrO2
MolecularWeight:
229.0706
MdlNumber:
MFCD00016329
Smiles:
CCOC(=O)c1ccc(cc1)Br
NscNumber:
67387
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1ccc(cc1)Br
NscNumber: __
Complexity: 127
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1ccc(cc1)Br
NscNumber:
__
Complexity:
127
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1ccc(cc1)Br
NscNumber: __
Complexity: 75
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1ccc(cc1)Br
NscNumber:
__
Complexity:
75
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccc(cc1)Br
NscNumber: __
Complexity: 77
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccc(cc1)Br
NscNumber:
__
Complexity:
77
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9