AA80401
158435-41-7 | 4-Bromo-2-chlorobenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AA80401
ChemicalName
4-Bromo-2-chlorobenzaldehyde
CasNumber
158435-41-7
MolecularFormula
C7H4BrClO
MolecularWeight
219.4631
MdlNumber
MFCD08741413
Smiles
O=Cc1ccc(cc1Cl)Br
Complexity
129
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2.7
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CatalogNumber: AA80401
ChemicalName: 4-Bromo-2-chlorobenzaldehyde
CasNumber: 158435-41-7
MolecularFormula: C7H4BrClO
MolecularWeight: 219.4631
MdlNumber: MFCD08741413
Smiles: O=Cc1ccc(cc1Cl)Br
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AA80401
ChemicalName:
4-Bromo-2-chlorobenzaldehyde
CasNumber:
158435-41-7
MolecularFormula:
C7H4BrClO
MolecularWeight:
219.4631
MdlNumber:
MFCD08741413
Smiles:
O=Cc1ccc(cc1Cl)Br
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: AA80403
ChemicalName: 4-Carboxy-2-methylphenylboronic acid
CasNumber: 158429-66-4
MolecularFormula: C8H9BO4
MolecularWeight: 179.9657
MdlNumber: MFCD09037833
Smiles: OC(=O)c1ccc(c(c1)C)B(O)O
Complexity: 195
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AA80403
ChemicalName:
4-Carboxy-2-methylphenylboronic acid
CasNumber:
158429-66-4
MolecularFormula:
C8H9BO4
MolecularWeight:
179.9657
MdlNumber:
MFCD09037833
Smiles:
OC(=O)c1ccc(c(c1)C)B(O)O
Complexity:
195
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1OC1CCCC1)C(=O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1OC1CCCC1)C(=O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA80405
ChemicalName: 4-(Methoxycarbonyl)-2-methylphenylboronic acid
CasNumber: 158429-38-0
MolecularFormula: C27H33B3O12
MolecularWeight: 581.9767
MdlNumber: MFCD08062669
Smiles: COC(=O)c1ccc(c(c1)C)B(O)O.COC(=O)c1ccc(c(c1)C)B(O)O.COC(=O)c1ccc(c(c1)C)B(O)O
Complexity: 207
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AA80405
ChemicalName:
4-(Methoxycarbonyl)-2-methylphenylboronic acid
CasNumber:
158429-38-0
MolecularFormula:
C27H33B3O12
MolecularWeight:
581.9767
MdlNumber:
MFCD08062669
Smiles:
COC(=O)c1ccc(c(c1)C)B(O)O.COC(=O)c1ccc(c(c1)C)B(O)O.COC(=O)c1ccc(c(c1)C)B(O)O
Complexity:
207
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
__