AB12178
190656-34-9 | (5-Bromo-2-fluorophenyl)methanamine
Manufacturer: A2B Chem
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CatalogNumber
AB12178
ChemicalName
(5-Bromo-2-fluorophenyl)methanamine
CasNumber
190656-34-9
MolecularFormula
C7H7BrFN
MolecularWeight
204.0395832
MdlNumber
MFCD06212854
Smiles
NCc1cc(Br)ccc1F
Complexity
110
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AB12178
ChemicalName: (5-Bromo-2-fluorophenyl)methanamine
CasNumber: 190656-34-9
MolecularFormula: C7H7BrFN
MolecularWeight: 204.0395832
MdlNumber: MFCD06212854
Smiles: NCc1cc(Br)ccc1F
Complexity: 110
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AB12178
ChemicalName:
(5-Bromo-2-fluorophenyl)methanamine
CasNumber:
190656-34-9
MolecularFormula:
C7H7BrFN
MolecularWeight:
204.0395832
MdlNumber:
MFCD06212854
Smiles:
NCc1cc(Br)ccc1F
Complexity:
110
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ONC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 311
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ONC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
311
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(cc1)CNCc1ccccc1
Complexity: 266
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(cc1)CNCc1ccccc1
Complexity:
266
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: AB12184
ChemicalName: O-(4-Bromo-2-fluorophenyl) dimethylcarbamothioate
CasNumber: 190648-99-8
MolecularFormula: C9H9BrFNOS
MolecularWeight: 278.1413
MdlNumber: MFCD09258772
Smiles: Brc1ccc(c(c1)F)OC(=S)N(C)C
Complexity: 215
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AB12184
ChemicalName:
O-(4-Bromo-2-fluorophenyl) dimethylcarbamothioate
CasNumber:
190648-99-8
MolecularFormula:
C9H9BrFNOS
MolecularWeight:
278.1413
MdlNumber:
MFCD09258772
Smiles:
Brc1ccc(c(c1)F)OC(=S)N(C)C
Complexity:
215
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.1