AB08457
198959-37-4 | Methyl 3-pyrrolidinecarboxylate HCl
Manufacturer: A2B Chem
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CatalogNumber
AB08457
ChemicalName
Methyl 3-pyrrolidinecarboxylate HCl
CasNumber
198959-37-4
MolecularFormula
C6H12ClNO2
MolecularWeight
165.618
MdlNumber
MFCD08436169
Smiles
COC(=O)C1CNCC1.Cl
Complexity
114
Covalently-bondedUnitCount
2
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
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CatalogNumber: AB08457
ChemicalName: Methyl 3-pyrrolidinecarboxylate HCl
CasNumber: 198959-37-4
MolecularFormula: C6H12ClNO2
MolecularWeight: 165.618
MdlNumber: MFCD08436169
Smiles: COC(=O)C1CNCC1.Cl
Complexity: 114
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AB08457
ChemicalName:
Methyl 3-pyrrolidinecarboxylate HCl
CasNumber:
198959-37-4
MolecularFormula:
C6H12ClNO2
MolecularWeight:
165.618
MdlNumber:
MFCD08436169
Smiles:
COC(=O)C1CNCC1.Cl
Complexity:
114
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC1(CO)COC(=N1)CCCCC1=NC(CO1)(CO)CO
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC1(CO)COC(=N1)CCCCC1=NC(CO1)(CO)CO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)COC(=N1)CCC1=NC(CO1)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)COC(=N1)CCC1=NC(CO1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: AB08464
ChemicalName: Benzyl 3-oxocyclobutanecarboxylate
CasNumber: 198995-91-4
MolecularFormula: C12H12O3
MolecularWeight: 204.2219
MdlNumber: MFCD11848894
Smiles: O=C(C1CC(=O)C1)OCc1ccccc1
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
CatalogNumber:
AB08464
ChemicalName:
Benzyl 3-oxocyclobutanecarboxylate
CasNumber:
198995-91-4
MolecularFormula:
C12H12O3
MolecularWeight:
204.2219
MdlNumber:
MFCD11848894
Smiles:
O=C(C1CC(=O)C1)OCc1ccccc1
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__