AB75917
71486-53-8 | Methyl 4-oxo-3-piperidinecarboxylate, HCl
Manufacturer: A2B Chem
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CatalogNumber
AB75917
ChemicalName
Methyl 4-oxo-3-piperidinecarboxylate, HCl
CasNumber
71486-53-8
MolecularFormula
C7H11ClNO3
MolecularWeight
193.6281
MdlNumber
MFCD00012769
Smiles
COC(=O)C1CNCCC1=O.[H+].[Cl-]
Complexity
179
Covalently-bondedUnitCount
2
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
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CatalogNumber: AB75917
ChemicalName: Methyl 4-oxo-3-piperidinecarboxylate, HCl
CasNumber: 71486-53-8
MolecularFormula: C7H11ClNO3
MolecularWeight: 193.6281
MdlNumber: MFCD00012769
Smiles: COC(=O)C1CNCCC1=O.[H+].[Cl-]
Complexity: 179
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AB75917
ChemicalName:
Methyl 4-oxo-3-piperidinecarboxylate, HCl
CasNumber:
71486-53-8
MolecularFormula:
C7H11ClNO3
MolecularWeight:
193.6281
MdlNumber:
MFCD00012769
Smiles:
COC(=O)C1CNCCC1=O.[H+].[Cl-]
Complexity:
179
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
CatalogNumber: AB75918
ChemicalName: Methyl pent-4-enoate
CasNumber: 818-57-5
MolecularFormula: C6H10O2
MolecularWeight: 114.1424
MdlNumber: MFCD03990590
Smiles: COC(=O)CCC=C
Complexity: 86.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
CatalogNumber:
AB75918
ChemicalName:
Methyl pent-4-enoate
CasNumber:
818-57-5
MolecularFormula:
C6H10O2
MolecularWeight:
114.1424
MdlNumber:
MFCD03990590
Smiles:
COC(=O)CCC=C
Complexity:
86.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
CatalogNumber: AB75919
ChemicalName: Methyl 4-pyridinylacetate
CasNumber: 29800-89-3
MolecularFormula: C8H9NO2
MolecularWeight: 151.1626
MdlNumber: MFCD00972014
Smiles: COC(=O)Cc1ccncc1
Complexity: 130
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
CatalogNumber:
AB75919
ChemicalName:
Methyl 4-pyridinylacetate
CasNumber:
29800-89-3
MolecularFormula:
C8H9NO2
MolecularWeight:
151.1626
MdlNumber:
MFCD00972014
Smiles:
COC(=O)Cc1ccncc1
Complexity:
130
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
CatalogNumber: AB75920
ChemicalName: Methyl 4-thiocyanatobutanoate
CasNumber: 79203-77-3
MolecularFormula: C6H9NO2S
MolecularWeight: 159.2062
MdlNumber: MFCD15143541
Smiles: N#CSCCCC(=O)OC
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 5
UndefinedAtomStereocenterCount: __
CatalogNumber:
AB75920
ChemicalName:
Methyl 4-thiocyanatobutanoate
CasNumber:
79203-77-3
MolecularFormula:
C6H9NO2S
MolecularWeight:
159.2062
MdlNumber:
MFCD15143541
Smiles:
N#CSCCCC(=O)OC
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
__