AB46445
161491-24-3 | Methyl 1-BOC-4-oxopiperidine-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB46445
ChemicalName
Methyl 1-BOC-4-oxopiperidine-3-carboxylate
CasNumber
161491-24-3
MolecularFormula
C12H19NO5
MolecularWeight
257.283
MdlNumber
MFCD08752608
Smiles
COC(=O)C1CN(CCC1=O)C(=O)OC(C)(C)C
Complexity
358
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
0.7
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CatalogNumber: AB46445
ChemicalName: Methyl 1-BOC-4-oxopiperidine-3-carboxylate
CasNumber: 161491-24-3
MolecularFormula: C12H19NO5
MolecularWeight: 257.283
MdlNumber: MFCD08752608
Smiles: COC(=O)C1CN(CCC1=O)C(=O)OC(C)(C)C
Complexity: 358
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.7
CatalogNumber:
AB46445
ChemicalName:
Methyl 1-BOC-4-oxopiperidine-3-carboxylate
CasNumber:
161491-24-3
MolecularFormula:
C12H19NO5
MolecularWeight:
257.283
MdlNumber:
MFCD08752608
Smiles:
COC(=O)C1CN(CCC1=O)C(=O)OC(C)(C)C
Complexity:
358
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)Cn1cncc1
Complexity: 127
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cn1cncc1
Complexity:
127
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB46447
ChemicalName: Methyl (chlorosulfonyl)acetate
CasNumber: 56146-83-9
MolecularFormula: C3H5ClO4S
MolecularWeight: 172.5874
MdlNumber: MFCD00075558
Smiles: COC(=O)CS(=O)(=O)Cl
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 0.3
CatalogNumber:
AB46447
ChemicalName:
Methyl (chlorosulfonyl)acetate
CasNumber:
56146-83-9
MolecularFormula:
C3H5ClO4S
MolecularWeight:
172.5874
MdlNumber:
MFCD00075558
Smiles:
COC(=O)CS(=O)(=O)Cl
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C(S(=O)(=O)F)(F)F
Complexity: 250
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C(S(=O)(=O)F)(F)F
Complexity:
250
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.8