AB50401
19406-00-9 | Methyl 2-oxotetrahydrofuran-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB50401
ChemicalName
Methyl 2-oxotetrahydrofuran-3-carboxylate
CasNumber
19406-00-9
MolecularFormula
C6H8O4
MolecularWeight
144.1253
MdlNumber
MFCD10569624
Smiles
COC(=O)C1CCOC1=O
NscNumber
238957
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
0.3
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CatalogNumber: AB50401
ChemicalName: Methyl 2-oxotetrahydrofuran-3-carboxylate
CasNumber: 19406-00-9
MolecularFormula: C6H8O4
MolecularWeight: 144.1253
MdlNumber: MFCD10569624
Smiles: COC(=O)C1CCOC1=O
NscNumber: 238957
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.3
CatalogNumber:
AB50401
ChemicalName:
Methyl 2-oxotetrahydrofuran-3-carboxylate
CasNumber:
19406-00-9
MolecularFormula:
C6H8O4
MolecularWeight:
144.1253
MdlNumber:
MFCD10569624
Smiles:
COC(=O)C1CCOC1=O
NscNumber:
238957
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cncc2c1c(ccc2)S(=O)(=O)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cncc2c1c(ccc2)S(=O)(=O)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1n[nH]c2c1cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1n[nH]c2c1cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1snc(c1Cl)Cl
NscNumber: __
Complexity: 156
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1snc(c1Cl)Cl
NscNumber:
__
Complexity:
156
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.4