AE24550
1035262-89-5 | (4-Chloro-3-fluorophenyl)acetic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AE24550
ChemicalName
(4-Chloro-3-fluorophenyl)acetic acid methyl ester
CasNumber
1035262-89-5
MolecularFormula
C9H8ClFO2
MolecularWeight
202.61
MdlNumber
MFCD11110082
Smiles
COC(=O)Cc1ccc(c(c1)F)Cl
Complexity
187
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.4
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CatalogNumber: AE24550
ChemicalName: (4-Chloro-3-fluorophenyl)acetic acid methyl ester
CasNumber: 1035262-89-5
MolecularFormula: C9H8ClFO2
MolecularWeight: 202.61
MdlNumber: MFCD11110082
Smiles: COC(=O)Cc1ccc(c(c1)F)Cl
Complexity: 187
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AE24550
ChemicalName:
(4-Chloro-3-fluorophenyl)acetic acid methyl ester
CasNumber:
1035262-89-5
MolecularFormula:
C9H8ClFO2
MolecularWeight:
202.61
MdlNumber:
MFCD11110082
Smiles:
COC(=O)Cc1ccc(c(c1)F)Cl
Complexity:
187
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: AE24551
ChemicalName: 4-(2-(Methoxycarbonyl)cyclopropyl)benzoic acid
CasNumber: 1057107-39-7
MolecularFormula: C12H12O4
MolecularWeight: 220.2213
MdlNumber: MFCD22393665
Smiles: COC(=O)C1CC1c1ccc(cc1)C(=O)O
Complexity: 291
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 1.5
CatalogNumber:
AE24551
ChemicalName:
4-(2-(Methoxycarbonyl)cyclopropyl)benzoic acid
CasNumber:
1057107-39-7
MolecularFormula:
C12H12O4
MolecularWeight:
220.2213
MdlNumber:
MFCD22393665
Smiles:
COC(=O)C1CC1c1ccc(cc1)C(=O)O
Complexity:
291
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
1.5
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Smiles: N1CCN(CC1)c1cccc2c1cn[nH]2
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N1CCN(CC1)c1cccc2c1cn[nH]2
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Smiles: CCOc1n[nH]cc1I
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CCOc1n[nH]cc1I
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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