AD16936
651027-00-8 | 4-Bromo-3,5-difluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD16936
ChemicalName
4-Bromo-3,5-difluorobenzoic acid
CasNumber
651027-00-8
MolecularFormula
C7H3BrF2O2
MolecularWeight
236.9983
MdlNumber
MFCD18917156
Smiles
OC(=O)c1cc(F)c(c(c1)F)Br
Complexity
176
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AD16936
ChemicalName: 4-Bromo-3,5-difluorobenzoic acid
CasNumber: 651027-00-8
MolecularFormula: C7H3BrF2O2
MolecularWeight: 236.9983
MdlNumber: MFCD18917156
Smiles: OC(=O)c1cc(F)c(c(c1)F)Br
Complexity: 176
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AD16936
ChemicalName:
4-Bromo-3,5-difluorobenzoic acid
CasNumber:
651027-00-8
MolecularFormula:
C7H3BrF2O2
MolecularWeight:
236.9983
MdlNumber:
MFCD18917156
Smiles:
OC(=O)c1cc(F)c(c(c1)F)Br
Complexity:
176
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=S(=O)(c1ccccc1)Cc1c[nH]c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=S(=O)(c1ccccc1)Cc1c[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD16976
ChemicalName: 4,7-Dichloro-1H-indole
CasNumber: 96129-73-6
MolecularFormula: C8H5Cl2N
MolecularWeight: 186.038
MdlNumber: MFCD09749917
Smiles: Clc1ccc(c2c1[nH]cc2)Cl
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 3.3
CatalogNumber:
AD16976
ChemicalName:
4,7-Dichloro-1H-indole
CasNumber:
96129-73-6
MolecularFormula:
C8H5Cl2N
MolecularWeight:
186.038
MdlNumber:
MFCD09749917
Smiles:
Clc1ccc(c2c1[nH]cc2)Cl
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(F)(F)F)N1c2ccccc2Sc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(F)(F)F)N1c2ccccc2Sc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__