AB24172
2363-16-8 | Methyl 4-bromo-3-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB24172
ChemicalName
Methyl 4-bromo-3-nitrobenzoate
CasNumber
2363-16-8
MolecularFormula
C8H6BrNO4
MolecularWeight
260.0415
MdlNumber
MFCD00553089
Smiles
COC(=O)c1ccc(c(c1)[N+](=O)[O-])Br
Complexity
240
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AB24172
ChemicalName: Methyl 4-bromo-3-nitrobenzoate
CasNumber: 2363-16-8
MolecularFormula: C8H6BrNO4
MolecularWeight: 260.0415
MdlNumber: MFCD00553089
Smiles: COC(=O)c1ccc(c(c1)[N+](=O)[O-])Br
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AB24172
ChemicalName:
Methyl 4-bromo-3-nitrobenzoate
CasNumber:
2363-16-8
MolecularFormula:
C8H6BrNO4
MolecularWeight:
260.0415
MdlNumber:
MFCD00553089
Smiles:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])Br
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COCOc1c(Br)cc(cc1OC)C=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COCOc1c(Br)cc(cc1OC)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1ccc2-c3c(C4(c2c1)c1ccccc1-c1c4cccc1)cccc3)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1ccc2-c3c(C4(c2c1)c1ccccc1-c1c4cccc1)cccc3)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB24176
ChemicalName: Potassium (2-methoxyphenyl)trifluoroborate
CasNumber: 236388-46-8
MolecularFormula: C7H7BF3KO
MolecularWeight: 214.0343896
MdlNumber: MFCD04115756
Smiles: COc1ccccc1[B-](F)(F)F.[K+]
Complexity: 153
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB24176
ChemicalName:
Potassium (2-methoxyphenyl)trifluoroborate
CasNumber:
236388-46-8
MolecularFormula:
C7H7BF3KO
MolecularWeight:
214.0343896
MdlNumber:
MFCD04115756
Smiles:
COc1ccccc1[B-](F)(F)F.[K+]
Complexity:
153
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
__