AA45409
129540-23-4 | 2-(2-Methylphenyl)pyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AA45409
ChemicalName
2-(2-Methylphenyl)pyrrolidine
CasNumber
129540-23-4
MolecularFormula
C11H15N
MolecularWeight
161.2435
MdlNumber
MFCD02663451
Smiles
Cc1ccccc1C1CCCN1
Complexity
144
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.2
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CatalogNumber: AA45409
ChemicalName: 2-(2-Methylphenyl)pyrrolidine
CasNumber: 129540-23-4
MolecularFormula: C11H15N
MolecularWeight: 161.2435
MdlNumber: MFCD02663451
Smiles: Cc1ccccc1C1CCCN1
Complexity: 144
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.2
CatalogNumber:
AA45409
ChemicalName:
2-(2-Methylphenyl)pyrrolidine
CasNumber:
129540-23-4
MolecularFormula:
C11H15N
MolecularWeight:
161.2435
MdlNumber:
MFCD02663451
Smiles:
Cc1ccccc1C1CCCN1
Complexity:
144
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.2
CatalogNumber: AA45410
ChemicalName: 2-(2-Chlorophenyl)pyrrolidine
CasNumber: 129540-21-2
MolecularFormula: C10H12ClN
MolecularWeight: 181.662
MdlNumber: MFCD02089473
Smiles: Clc1ccccc1C1CCCN1
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.4
CatalogNumber:
AA45410
ChemicalName:
2-(2-Chlorophenyl)pyrrolidine
CasNumber:
129540-21-2
MolecularFormula:
C10H12ClN
MolecularWeight:
181.662
MdlNumber:
MFCD02089473
Smiles:
Clc1ccccc1C1CCCN1
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.4
CatalogNumber: __
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MolecularFormula: __
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Smiles: BrCc1cc(OCc2cc(OCc3ccccc3)cc(c2)OCc2ccccc2)cc(c1)OCc1cc(OCc2ccccc2)cc(c1)OCc1ccccc1
Complexity: __
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Smiles:
BrCc1cc(OCc2cc(OCc3ccccc3)cc(c2)OCc2ccccc2)cc(c1)OCc1cc(OCc2ccccc2)cc(c1)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(=O)N)CCCNC(=N)N)NCC(Cc1ccccc1)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(=O)N)CCCNC(=N)N)NCC(Cc1ccccc1)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__