AI62318
93271-75-1 | Dimethyl 2-(2-pyrimidyl)malonate
Manufacturer: A2B Chem
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CatalogNumber
AI62318
ChemicalName
Dimethyl 2-(2-pyrimidyl)malonate
CasNumber
93271-75-1
MolecularFormula
C9H10N2O4
MolecularWeight
210.1867
MdlNumber
MFCD12198886
Smiles
COC(=O)C(c1ncccn1)C(=O)OC
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
RotatableBondCount
5
Xlogp3
0.1
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CatalogNumber: AI62318
ChemicalName: Dimethyl 2-(2-pyrimidyl)malonate
CasNumber: 93271-75-1
MolecularFormula: C9H10N2O4
MolecularWeight: 210.1867
MdlNumber: MFCD12198886
Smiles: COC(=O)C(c1ncccn1)C(=O)OC
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
RotatableBondCount: 5
Xlogp3: 0.1
CatalogNumber:
AI62318
ChemicalName:
Dimethyl 2-(2-pyrimidyl)malonate
CasNumber:
93271-75-1
MolecularFormula:
C9H10N2O4
MolecularWeight:
210.1867
MdlNumber:
MFCD12198886
Smiles:
COC(=O)C(c1ncccn1)C(=O)OC
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
RotatableBondCount:
5
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CCOC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)Cc1ccc(cc1)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
CCOC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)Cc1ccc(cc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
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Smiles: CNc1nc(cs1)c1cc(Cl)ncn1
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Smiles:
CNc1nc(cs1)c1cc(Cl)ncn1
Complexity:
__
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: [N-]=[N+]=NCCOCCOCCNC(=O)CBr
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HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
[N-]=[N+]=NCCOCCOCCNC(=O)CBr
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__