AD37123
367-79-3 | Ethyl 2-fluoro-5-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AD37123
ChemicalName
Ethyl 2-fluoro-5-nitrobenzoate
CasNumber
367-79-3
MolecularFormula
C9H8FNO4
MolecularWeight
213.1625
MdlNumber
MFCD06204381
Smiles
[O-][N+](=O)c1cc(C(=O)OCC)c(cc1)F
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AD37123
ChemicalName: Ethyl 2-fluoro-5-nitrobenzoate
CasNumber: 367-79-3
MolecularFormula: C9H8FNO4
MolecularWeight: 213.1625
MdlNumber: MFCD06204381
Smiles: [O-][N+](=O)c1cc(C(=O)OCC)c(cc1)F
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AD37123
ChemicalName:
Ethyl 2-fluoro-5-nitrobenzoate
CasNumber:
367-79-3
MolecularFormula:
C9H8FNO4
MolecularWeight:
213.1625
MdlNumber:
MFCD06204381
Smiles:
[O-][N+](=O)c1cc(C(=O)OCC)c(cc1)F
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: AD37129
ChemicalName: 3-(Benzyloxy)-5-methylphenol
CasNumber: 36776-44-0
MolecularFormula: C14H14O2
MolecularWeight: 214.2598
MdlNumber: MFCD24713740
Smiles: Cc1cc(O)c(c(c1)O)Cc1ccccc1
Complexity: 199
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.4
CatalogNumber:
AD37129
ChemicalName:
3-(Benzyloxy)-5-methylphenol
CasNumber:
36776-44-0
MolecularFormula:
C14H14O2
MolecularWeight:
214.2598
MdlNumber:
MFCD24713740
Smiles:
Cc1cc(O)c(c(c1)O)Cc1ccccc1
Complexity:
199
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.4
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Smiles: COc1ccc(c(n1)Sc1ccc(cc1)Cl)N
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COc1ccc(c(n1)Sc1ccc(cc1)Cl)N
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Smiles: CC(C(=O)c1ccc(c(c1)Cl)C)Br
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Smiles:
CC(C(=O)c1ccc(c(c1)Cl)C)Br
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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