AB48392
759-65-9 | Methyloxalacetic acid diethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB48392
ChemicalName
Methyloxalacetic acid diethyl ester
CasNumber
759-65-9
MolecularFormula
C9H14O5
MolecularWeight
202.2045
MdlNumber
MFCD00009163
Smiles
CCOC(=O)C(=O)C(C(=O)OCC)C
NscNumber
33946
Complexity
233
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
7
UndefinedAtomStereocenterCount
1
Xlogp3
1.3
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CatalogNumber: AB48392
ChemicalName: Methyloxalacetic acid diethyl ester
CasNumber: 759-65-9
MolecularFormula: C9H14O5
MolecularWeight: 202.2045
MdlNumber: MFCD00009163
Smiles: CCOC(=O)C(=O)C(C(=O)OCC)C
NscNumber: 33946
Complexity: 233
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 7
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.3
CatalogNumber:
AB48392
ChemicalName:
Methyloxalacetic acid diethyl ester
CasNumber:
759-65-9
MolecularFormula:
C9H14O5
MolecularWeight:
202.2045
MdlNumber:
MFCD00009163
Smiles:
CCOC(=O)C(=O)C(C(=O)OCC)C
NscNumber:
33946
Complexity:
233
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O/N=C(/c1ccccc1)\Cc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O/N=C(/c1ccccc1)\Cc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB48394
ChemicalName: 1-Oxaspiro[4.5]decan-2-one
CasNumber: 699-61-6
MolecularFormula: C9H14O2
MolecularWeight: 154.2063
MdlNumber: MFCD00459846
Smiles: O=C1CCC2(O1)CCCCC2
NscNumber: __
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.8
CatalogNumber:
AB48394
ChemicalName:
1-Oxaspiro[4.5]decan-2-one
CasNumber:
699-61-6
MolecularFormula:
C9H14O2
MolecularWeight:
154.2063
MdlNumber:
MFCD00459846
Smiles:
O=C1CCC2(O1)CCCCC2
NscNumber:
__
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.8
CatalogNumber: AB48395
ChemicalName: tert-butyl N-ethenylcarbamate
CasNumber: 7150-72-3
MolecularFormula: C7H13NO2
MolecularWeight: 143.1836
MdlNumber: MFCD00081075
Smiles: C=CNC(=O)OC(C)(C)C
NscNumber: 72468
Complexity: 135
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 1.4
CatalogNumber:
AB48395
ChemicalName:
tert-butyl N-ethenylcarbamate
CasNumber:
7150-72-3
MolecularFormula:
C7H13NO2
MolecularWeight:
143.1836
MdlNumber:
MFCD00081075
Smiles:
C=CNC(=O)OC(C)(C)C
NscNumber:
72468
Complexity:
135
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.4