AD39735
383127-22-8 | 2-(4-Bromo-phenyl)-pyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AD39735
ChemicalName
2-(4-Bromo-phenyl)-pyrrolidine
CasNumber
383127-22-8
MolecularFormula
C10H12BrN
MolecularWeight
226.113
MdlNumber
MFCD02663432
Smiles
Brc1ccc(cc1)C1CCCN1
Complexity
141
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.5
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CatalogNumber: AD39735
ChemicalName: 2-(4-Bromo-phenyl)-pyrrolidine
CasNumber: 383127-22-8
MolecularFormula: C10H12BrN
MolecularWeight: 226.113
MdlNumber: MFCD02663432
Smiles: Brc1ccc(cc1)C1CCCN1
Complexity: 141
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.5
CatalogNumber:
AD39735
ChemicalName:
2-(4-Bromo-phenyl)-pyrrolidine
CasNumber:
383127-22-8
MolecularFormula:
C10H12BrN
MolecularWeight:
226.113
MdlNumber:
MFCD02663432
Smiles:
Brc1ccc(cc1)C1CCCN1
Complexity:
141
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.5
CatalogNumber: AD39738
ChemicalName: 1-Methyl-4-(trifluoromethylsulfonyl)benzene
CasNumber: 383-10-8
MolecularFormula: C8H7F3O2S
MolecularWeight: 224.20018959999996
MdlNumber: MFCD00523749
Smiles: FC(S(=O)(=O)c1ccc(cc1)C)(F)F
Complexity: 281
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 3
CatalogNumber:
AD39738
ChemicalName:
1-Methyl-4-(trifluoromethylsulfonyl)benzene
CasNumber:
383-10-8
MolecularFormula:
C8H7F3O2S
MolecularWeight:
224.20018959999996
MdlNumber:
MFCD00523749
Smiles:
FC(S(=O)(=O)c1ccc(cc1)C)(F)F
Complexity:
281
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC1(Br)CCC1(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC1(Br)CCC1(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)C=C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)C=C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__