AA60570
13937-08-1 | Diethyl 2-hydroxymalonate
Manufacturer: A2B Chem
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CatalogNumber
AA60570
ChemicalName
Diethyl 2-hydroxymalonate
CasNumber
13937-08-1
MolecularFormula
C7H12O5
MolecularWeight
176.1672
MdlNumber
MFCD04038932
Smiles
CCOC(=O)C(C(=O)OCC)O
Complexity
147
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
0.3
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CatalogNumber: AA60570
ChemicalName: Diethyl 2-hydroxymalonate
CasNumber: 13937-08-1
MolecularFormula: C7H12O5
MolecularWeight: 176.1672
MdlNumber: MFCD04038932
Smiles: CCOC(=O)C(C(=O)OCC)O
Complexity: 147
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 0.3
CatalogNumber:
AA60570
ChemicalName:
Diethyl 2-hydroxymalonate
CasNumber:
13937-08-1
MolecularFormula:
C7H12O5
MolecularWeight:
176.1672
MdlNumber:
MFCD04038932
Smiles:
CCOC(=O)C(C(=O)OCC)O
Complexity:
147
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCCc2c1c[nH]n2)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CCCc2c1c[nH]n2)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Brc1ccc2c(c1)n(c1ccc(cc1)c1ccccc1)c1c2cccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Brc1ccc2c(c1)n(c1ccc(cc1)c1ccccc1)c1c2cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C1(O)CCC(CC1)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C1(O)CCC(CC1)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__