AI63500
946707-55-7 | 4-(3-Methoxypropoxy)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI63500
ChemicalName
4-(3-Methoxypropoxy)benzoic acid
CasNumber
946707-55-7
MolecularFormula
C11H14O4
MolecularWeight
210.2265
MdlNumber
MFCD12762368
Smiles
COCCCOc1ccc(cc1)C(=O)O
Complexity
185
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
2.4
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CatalogNumber: AI63500
ChemicalName: 4-(3-Methoxypropoxy)benzoic acid
CasNumber: 946707-55-7
MolecularFormula: C11H14O4
MolecularWeight: 210.2265
MdlNumber: MFCD12762368
Smiles: COCCCOc1ccc(cc1)C(=O)O
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 2.4
CatalogNumber:
AI63500
ChemicalName:
4-(3-Methoxypropoxy)benzoic acid
CasNumber:
946707-55-7
MolecularFormula:
C11H14O4
MolecularWeight:
210.2265
MdlNumber:
MFCD12762368
Smiles:
COCCCOc1ccc(cc1)C(=O)O
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
2.4
CatalogNumber: AI63501
ChemicalName: 4-Fluoro-3-methoxyphenylacetic acid
CasNumber: 946713-86-6
MolecularFormula: C9H9FO3
MolecularWeight: 184.1644
MdlNumber: MFCD08146650
Smiles: COc1cc(ccc1F)CC(=O)O
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AI63501
ChemicalName:
4-Fluoro-3-methoxyphenylacetic acid
CasNumber:
946713-86-6
MolecularFormula:
C9H9FO3
MolecularWeight:
184.1644
MdlNumber:
MFCD08146650
Smiles:
COc1cc(ccc1F)CC(=O)O
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.1
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Smiles: CCCCOC1CNCC1
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Smiles:
CCCCOC1CNCC1
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Smiles: COC(=O)c1cccc(c1)OC1CNCC1
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Smiles:
COC(=O)c1cccc(c1)OC1CNCC1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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