AD72743
140695-84-7 | tert-Butyl (3S)-3-(hydroxymethyl)piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD72743
ChemicalName
tert-Butyl (3S)-3-(hydroxymethyl)piperidine-1-carboxylate
CasNumber
140695-84-7
MolecularFormula
C11H21NO3
MolecularWeight
215.28934000000007
MdlNumber
MFCD02683203
Smiles
OC[C@H]1CCCN(C1)C(=O)OC(C)(C)C
Complexity
222
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.2
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CatalogNumber: AD72743
ChemicalName: tert-Butyl (3S)-3-(hydroxymethyl)piperidine-1-carboxylate
CasNumber: 140695-84-7
MolecularFormula: C11H21NO3
MolecularWeight: 215.28934000000007
MdlNumber: MFCD02683203
Smiles: OC[C@H]1CCCN(C1)C(=O)OC(C)(C)C
Complexity: 222
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AD72743
ChemicalName:
tert-Butyl (3S)-3-(hydroxymethyl)piperidine-1-carboxylate
CasNumber:
140695-84-7
MolecularFormula:
C11H21NO3
MolecularWeight:
215.28934000000007
MdlNumber:
MFCD02683203
Smiles:
OC[C@H]1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
222
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.2
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Smiles: CC(CC(=NNC(=O)N)C)C
Complexity: __
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Smiles:
CC(CC(=NNC(=O)N)C)C
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Smiles: COc1cccc(c1)C=NNC(=O)N
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Smiles:
COc1cccc(c1)C=NNC(=O)N
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
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Smiles: [O-]P(=O)(O)[O-]
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
[O-]P(=O)(O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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