AV18636
543741-43-1 | 2-(2-(4-Fluorobenzyl)phenyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AV18636
ChemicalName
2-(2-(4-Fluorobenzyl)phenyl)acetic acid
CasNumber
543741-43-1
MolecularFormula
C15H13FO2
MolecularWeight
244.2609
MdlNumber
MFCD28387783
Smiles
OC(=O)Cc1ccccc1Cc1ccc(cc1)F
Complexity
272
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.4
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CatalogNumber: AV18636
ChemicalName: 2-(2-(4-Fluorobenzyl)phenyl)acetic acid
CasNumber: 543741-43-1
MolecularFormula: C15H13FO2
MolecularWeight: 244.2609
MdlNumber: MFCD28387783
Smiles: OC(=O)Cc1ccccc1Cc1ccc(cc1)F
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.4
CatalogNumber:
AV18636
ChemicalName:
2-(2-(4-Fluorobenzyl)phenyl)acetic acid
CasNumber:
543741-43-1
MolecularFormula:
C15H13FO2
MolecularWeight:
244.2609
MdlNumber:
MFCD28387783
Smiles:
OC(=O)Cc1ccccc1Cc1ccc(cc1)F
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.4
CatalogNumber: AV18637
ChemicalName: Ethyl 4-hydroxychroman-2-carboxylate
CasNumber: 124524-76-1
MolecularFormula: C12H14O4
MolecularWeight: 222.2372
MdlNumber: MFCD30185145
Smiles: CCOC(=O)C1CC(O)c2c(O1)cccc2
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.5
CatalogNumber:
AV18637
ChemicalName:
Ethyl 4-hydroxychroman-2-carboxylate
CasNumber:
124524-76-1
MolecularFormula:
C12H14O4
MolecularWeight:
222.2372
MdlNumber:
MFCD30185145
Smiles:
CCOC(=O)C1CC(O)c2c(O1)cccc2
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.5
CatalogNumber: AV18638
ChemicalName: 5,6-Dihydroxy-2-azabicyclo[2.2.1]heptan-3-one
CasNumber: 143396-01-4
MolecularFormula: C6H9NO3
MolecularWeight: 143.1406
MdlNumber: MFCD19217267
Smiles: O=C1NC2CC1C(C2O)O
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: __
Xlogp3: -1.8
CatalogNumber:
AV18638
ChemicalName:
5,6-Dihydroxy-2-azabicyclo[2.2.1]heptan-3-one
CasNumber:
143396-01-4
MolecularFormula:
C6H9NO3
MolecularWeight:
143.1406
MdlNumber:
MFCD19217267
Smiles:
O=C1NC2CC1C(C2O)O
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
__
Xlogp3:
-1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O/N=C(/C(C)(C)C)\N
Complexity: 102
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O/N=C(/C(C)(C)C)\N
Complexity:
102
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.8