AB63110
52221-92-8 | 3-(2-Bromo-phenyl)-propan-1-ol
Manufacturer: A2B Chem
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CatalogNumber
AB63110
ChemicalName
3-(2-Bromo-phenyl)-propan-1-ol
CasNumber
52221-92-8
MolecularFormula
C9H11BrO
MolecularWeight
215.087
MdlNumber
MFCD09028685
Smiles
OCCCc1ccccc1Br
Complexity
106
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.5
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CatalogNumber: AB63110
ChemicalName: 3-(2-Bromo-phenyl)-propan-1-ol
CasNumber: 52221-92-8
MolecularFormula: C9H11BrO
MolecularWeight: 215.087
MdlNumber: MFCD09028685
Smiles: OCCCc1ccccc1Br
Complexity: 106
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AB63110
ChemicalName:
3-(2-Bromo-phenyl)-propan-1-ol
CasNumber:
52221-92-8
MolecularFormula:
C9H11BrO
MolecularWeight:
215.087
MdlNumber:
MFCD09028685
Smiles:
OCCCc1ccccc1Br
Complexity:
106
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: AB63111
ChemicalName: 2-(2-Carboxyethyl)benzoic acid
CasNumber: 776-79-4
MolecularFormula: C10H10O4
MolecularWeight: 194.184
MdlNumber: MFCD00016550
Smiles: OC(=O)CCc1ccccc1C(=O)O
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.9
CatalogNumber:
AB63111
ChemicalName:
2-(2-Carboxyethyl)benzoic acid
CasNumber:
776-79-4
MolecularFormula:
C10H10O4
MolecularWeight:
194.184
MdlNumber:
MFCD00016550
Smiles:
OC(=O)CCc1ccccc1C(=O)O
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.9
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Smiles: COc1cccc(c1Cl)CCC(=O)O
Complexity: __
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Smiles:
COc1cccc(c1Cl)CCC(=O)O
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Smiles: Fc1cccc(c1c1noc(c1C(=O)Cl)C)Cl
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Smiles:
Fc1cccc(c1c1noc(c1C(=O)Cl)C)Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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