AE95336
18436-67-4 | 2-tert-Butyl-4-chloropyrimidine
Manufacturer: A2B Chem
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CatalogNumber
AE95336
ChemicalName
2-tert-Butyl-4-chloropyrimidine
CasNumber
18436-67-4
MolecularFormula
C8H11ClN2
MolecularWeight
170.6393
MdlNumber
MFCD10697056
Smiles
CC(c1nccc(n1)Cl)(C)C
Complexity
131
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AE95336
ChemicalName: 2-tert-Butyl-4-chloropyrimidine
CasNumber: 18436-67-4
MolecularFormula: C8H11ClN2
MolecularWeight: 170.6393
MdlNumber: MFCD10697056
Smiles: CC(c1nccc(n1)Cl)(C)C
Complexity: 131
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AE95336
ChemicalName:
2-tert-Butyl-4-chloropyrimidine
CasNumber:
18436-67-4
MolecularFormula:
C8H11ClN2
MolecularWeight:
170.6393
MdlNumber:
MFCD10697056
Smiles:
CC(c1nccc(n1)Cl)(C)C
Complexity:
131
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.9
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Smiles: COc1ccc2c(c1)CCC(C2=O)CC(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1ccc2c(c1)CCC(C2=O)CC(=O)O
Complexity:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC(C)C1=CC(=C(C=C1)Br)O
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Smiles:
CC(C)C1=CC(=C(C=C1)Br)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CS(=O)(=O)O.CN(C[C@H]1OCCn2cc(c3c2cccc3)C2=C(c3cn(CC1)c1ccccc31)C(=O)NC2=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CS(=O)(=O)O.CN(C[C@H]1OCCn2cc(c3c2cccc3)C2=C(c3cn(CC1)c1ccccc31)C(=O)NC2=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__