AI49040
36770-18-0 | 2-(Chloromethyl)-5-(3-methoxyphenyl)-1,3,4-oxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AI49040
ChemicalName
2-(Chloromethyl)-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CasNumber
36770-18-0
MolecularFormula
C10H9ClN2O2
MolecularWeight
224.6437
MdlNumber
MFCD08753714
Smiles
COc1cccc(c1)c1nnc(o1)CCl
Complexity
206
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AI49040
ChemicalName: 2-(Chloromethyl)-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CasNumber: 36770-18-0
MolecularFormula: C10H9ClN2O2
MolecularWeight: 224.6437
MdlNumber: MFCD08753714
Smiles: COc1cccc(c1)c1nnc(o1)CCl
Complexity: 206
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AI49040
ChemicalName:
2-(Chloromethyl)-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CasNumber:
36770-18-0
MolecularFormula:
C10H9ClN2O2
MolecularWeight:
224.6437
MdlNumber:
MFCD08753714
Smiles:
COc1cccc(c1)c1nnc(o1)CCl
Complexity:
206
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.8
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Smiles: OCC(=O)c1ccc(cc1)C#N
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
OCC(=O)c1ccc(cc1)C#N
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Smiles: Brc1cc(C)c(c(c1O)Br)Br
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Brc1cc(C)c(c(c1O)Br)Br
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Smiles: COC(=O)c1cc(cc(c1F)[N+](=O)[O-])[N+](=O)[O-]
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Smiles:
COC(=O)c1cc(cc(c1F)[N+](=O)[O-])[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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