AB35132
287714-35-6 | Methyl 2-chloropyrimidine-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB35132
ChemicalName
Methyl 2-chloropyrimidine-5-carboxylate
CasNumber
287714-35-6
MolecularFormula
C6H5ClN2O2
MolecularWeight
172.5691
MdlNumber
MFCD08690330
Smiles
COC(=O)c1cnc(nc1)Cl
Complexity
146
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1
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CatalogNumber: AB35132
ChemicalName: Methyl 2-chloropyrimidine-5-carboxylate
CasNumber: 287714-35-6
MolecularFormula: C6H5ClN2O2
MolecularWeight: 172.5691
MdlNumber: MFCD08690330
Smiles: COC(=O)c1cnc(nc1)Cl
Complexity: 146
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1
CatalogNumber:
AB35132
ChemicalName:
Methyl 2-chloropyrimidine-5-carboxylate
CasNumber:
287714-35-6
MolecularFormula:
C6H5ClN2O2
MolecularWeight:
172.5691
MdlNumber:
MFCD08690330
Smiles:
COC(=O)c1cnc(nc1)Cl
Complexity:
146
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1
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Smiles: Brc1c(Br)cccc1Br
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
Brc1c(Br)cccc1Br
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RotatableBondCount:
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Smiles: CCCCCCCCCCCCCCCCC=CC1CC(=O)OC1=O
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Smiles:
CCCCCCCCCCCCCCCCC=CC1CC(=O)OC1=O
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC(=O)N1C(=O)NC2C1NC(=O)N2C(=O)C
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Smiles:
CC(=O)N1C(=O)NC2C1NC(=O)N2C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__