AB44867
68837-59-2 | 4-Bromo-2-methylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB44867
ChemicalName
4-Bromo-2-methylbenzoic acid
CasNumber
68837-59-2
MolecularFormula
C8H7BrO2
MolecularWeight
215.044
MdlNumber
MFCD00040905
Smiles
Brc1ccc(c(c1)C)C(=O)O
NscNumber
243710
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.5
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CatalogNumber: AB44867
ChemicalName: 4-Bromo-2-methylbenzoic acid
CasNumber: 68837-59-2
MolecularFormula: C8H7BrO2
MolecularWeight: 215.044
MdlNumber: MFCD00040905
Smiles: Brc1ccc(c(c1)C)C(=O)O
NscNumber: 243710
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AB44867
ChemicalName:
4-Bromo-2-methylbenzoic acid
CasNumber:
68837-59-2
MolecularFormula:
C8H7BrO2
MolecularWeight:
215.044
MdlNumber:
MFCD00040905
Smiles:
Brc1ccc(c(c1)C)C(=O)O
NscNumber:
243710
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.5
CatalogNumber: AB44868
ChemicalName: 4-Bromo-2-methylbenzonitrile
CasNumber: 67832-11-5
MolecularFormula: C8H6BrN
MolecularWeight: 196.0439
MdlNumber: MFCD00041461
Smiles: N#Cc1ccc(cc1C)Br
NscNumber: 229305
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
AB44868
ChemicalName:
4-Bromo-2-methylbenzonitrile
CasNumber:
67832-11-5
MolecularFormula:
C8H6BrN
MolecularWeight:
196.0439
MdlNumber:
MFCD00041461
Smiles:
N#Cc1ccc(cc1C)Br
NscNumber:
229305
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=S)Nc1ccc(cc1C)Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=S)Nc1ccc(cc1C)Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB44870
ChemicalName: 4-Bromo-2-nitrobenzaldehyde
CasNumber: 5551-12-2
MolecularFormula: C7H4BrNO3
MolecularWeight: 230.0156
MdlNumber: MFCD00463687
Smiles: O=Cc1ccc(cc1N(=O)=O)Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB44870
ChemicalName:
4-Bromo-2-nitrobenzaldehyde
CasNumber:
5551-12-2
MolecularFormula:
C7H4BrNO3
MolecularWeight:
230.0156
MdlNumber:
MFCD00463687
Smiles:
O=Cc1ccc(cc1N(=O)=O)Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__