AI40755
1820703-37-4 | 2-Bromo-1-methanesulfonyl-4-(trifluoromethyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AI40755
ChemicalName
2-Bromo-1-methanesulfonyl-4-(trifluoromethyl)benzene
CasNumber
1820703-37-4
MolecularFormula
C8H6BrF3O2S
MolecularWeight
303.0962
MdlNumber
MFCD27578181
Smiles
Brc1cc(ccc1S(=O)(=O)C)C(F)(F)F
Complexity
320
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2.7
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CatalogNumber: AI40755
ChemicalName: 2-Bromo-1-methanesulfonyl-4-(trifluoromethyl)benzene
CasNumber: 1820703-37-4
MolecularFormula: C8H6BrF3O2S
MolecularWeight: 303.0962
MdlNumber: MFCD27578181
Smiles: Brc1cc(ccc1S(=O)(=O)C)C(F)(F)F
Complexity: 320
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AI40755
ChemicalName:
2-Bromo-1-methanesulfonyl-4-(trifluoromethyl)benzene
CasNumber:
1820703-37-4
MolecularFormula:
C8H6BrF3O2S
MolecularWeight:
303.0962
MdlNumber:
MFCD27578181
Smiles:
Brc1cc(ccc1S(=O)(=O)C)C(F)(F)F
Complexity:
320
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: AI40756
ChemicalName: 1-(Benzyloxy)-2-bromo-3-(trifluoromethyl)benzene
CasNumber: 1820703-43-2
MolecularFormula: C14H10BrF3O
MolecularWeight: 331.1278
MdlNumber: MFCD27981317
Smiles: Brc1c(cccc1C(F)(F)F)OCc1ccccc1
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 5
CatalogNumber:
AI40756
ChemicalName:
1-(Benzyloxy)-2-bromo-3-(trifluoromethyl)benzene
CasNumber:
1820703-43-2
MolecularFormula:
C14H10BrF3O
MolecularWeight:
331.1278
MdlNumber:
MFCD27981317
Smiles:
Brc1c(cccc1C(F)(F)F)OCc1ccccc1
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(Br)c(cc1[N+](=O)[O-])Cl
Complexity: 270
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(Br)c(cc1[N+](=O)[O-])Cl
Complexity:
270
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: AI40758
ChemicalName: 5-Acetamido-3-chloropyridine-2-carboxylic acid
CasNumber: 1820703-51-2
MolecularFormula: C8H7ClN2O3
MolecularWeight: 214.6058
MdlNumber: MFCD28101649
Smiles: CC(=O)Nc1cnc(c(c1)Cl)C(=O)O
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AI40758
ChemicalName:
5-Acetamido-3-chloropyridine-2-carboxylic acid
CasNumber:
1820703-51-2
MolecularFormula:
C8H7ClN2O3
MolecularWeight:
214.6058
MdlNumber:
MFCD28101649
Smiles:
CC(=O)Nc1cnc(c(c1)Cl)C(=O)O
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.5