AB61443
6967-82-4 | 2-Bromo-5-methylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB61443
ChemicalName
2-Bromo-5-methylbenzoic acid
CasNumber
6967-82-4
MolecularFormula
C8H7BrO2
MolecularWeight
215.044
MdlNumber
MFCD00079722
Smiles
Cc1ccc(c(c1)C(=O)O)Br
NscNumber
20686
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.3
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CatalogNumber: AB61443
ChemicalName: 2-Bromo-5-methylbenzoic acid
CasNumber: 6967-82-4
MolecularFormula: C8H7BrO2
MolecularWeight: 215.044
MdlNumber: MFCD00079722
Smiles: Cc1ccc(c(c1)C(=O)O)Br
NscNumber: 20686
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.3
CatalogNumber:
AB61443
ChemicalName:
2-Bromo-5-methylbenzoic acid
CasNumber:
6967-82-4
MolecularFormula:
C8H7BrO2
MolecularWeight:
215.044
MdlNumber:
MFCD00079722
Smiles:
Cc1ccc(c(c1)C(=O)O)Br
NscNumber:
20686
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.3
CatalogNumber: AB61444
ChemicalName: 2-Bromo-5-methylbenzonitrile
CasNumber: 42872-83-3
MolecularFormula: C8H6BrN
MolecularWeight: 196.04394000000002
MdlNumber: MFCD11040281
Smiles: N#Cc1cc(C)ccc1Br
NscNumber: __
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
AB61444
ChemicalName:
2-Bromo-5-methylbenzonitrile
CasNumber:
42872-83-3
MolecularFormula:
C8H6BrN
MolecularWeight:
196.04394000000002
MdlNumber:
MFCD11040281
Smiles:
N#Cc1cc(C)ccc1Br
NscNumber:
__
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(CCC(Br)C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(CCC(Br)C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB61446
ChemicalName: 2-Bromo-5-methylphenol
CasNumber: 14847-51-9
MolecularFormula: C7H7BrO
MolecularWeight: 187.0339
MdlNumber: MFCD11100989
Smiles: Cc1ccc(c(c1)O)Br
NscNumber: 21719
Complexity: 94.9
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
AB61446
ChemicalName:
2-Bromo-5-methylphenol
CasNumber:
14847-51-9
MolecularFormula:
C7H7BrO
MolecularWeight:
187.0339
MdlNumber:
MFCD11100989
Smiles:
Cc1ccc(c(c1)O)Br
NscNumber:
21719
Complexity:
94.9
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.4