AI60012
894797-00-3 | 5-Chloropyrimidine-2-carboxylic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI60012
ChemicalName
5-Chloropyrimidine-2-carboxylic acid methyl ester
CasNumber
894797-00-3
MolecularFormula
C6H5ClN2O2
MolecularWeight
172.5691
MdlNumber
MFCD16611603
Smiles
COC(=O)c1ncc(cn1)Cl
Complexity
146
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
-0.1
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CatalogNumber: AI60012
ChemicalName: 5-Chloropyrimidine-2-carboxylic acid methyl ester
CasNumber: 894797-00-3
MolecularFormula: C6H5ClN2O2
MolecularWeight: 172.5691
MdlNumber: MFCD16611603
Smiles: COC(=O)c1ncc(cn1)Cl
Complexity: 146
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: -0.1
CatalogNumber:
AI60012
ChemicalName:
5-Chloropyrimidine-2-carboxylic acid methyl ester
CasNumber:
894797-00-3
MolecularFormula:
C6H5ClN2O2
MolecularWeight:
172.5691
MdlNumber:
MFCD16611603
Smiles:
COC(=O)c1ncc(cn1)Cl
Complexity:
146
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: CC1=C(SC(=N1)NC(=O)OC2=CC=CC=C2)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC1=C(SC(=N1)NC(=O)OC2=CC=CC=C2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: CNc1ncc(nc1Br)Br
Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CNc1ncc(nc1Br)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)O)CC1CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)N[C@@H](C(=O)O)CC1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__