AI63388
945723-36-4 | (Trans-4-methylpyrrolidin-3-yl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AI63388
ChemicalName
(Trans-4-methylpyrrolidin-3-yl)methanol
CasNumber
945723-36-4
MolecularFormula
C6H13NO
MolecularWeight
115.1735
MdlNumber
MFCD14708210
Smiles
C[C@H]1CNC[C@@H]1CO
Complexity
74.9
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
8
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-0.1
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CatalogNumber: AI63388
ChemicalName: (Trans-4-methylpyrrolidin-3-yl)methanol
CasNumber: 945723-36-4
MolecularFormula: C6H13NO
MolecularWeight: 115.1735
MdlNumber: MFCD14708210
Smiles: C[C@H]1CNC[C@@H]1CO
Complexity: 74.9
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.1
CatalogNumber:
AI63388
ChemicalName:
(Trans-4-methylpyrrolidin-3-yl)methanol
CasNumber:
945723-36-4
MolecularFormula:
C6H13NO
MolecularWeight:
115.1735
MdlNumber:
MFCD14708210
Smiles:
C[C@H]1CNC[C@@H]1CO
Complexity:
74.9
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC=C(C=C1)COC2=CC(=C(C=C2)F)Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
C1=CC=C(C=C1)COC2=CC(=C(C=C2)F)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: CNc1cnc(cc1C(=O)O)Cl
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CNc1cnc(cc1C(=O)O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: C1CC(NC1)C(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5CCOCC5
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CC(NC1)C(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5CCOCC5
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__