AB48743
63297-02-9 | 3,3'-Dimethyl-[1,1'-biphenyl]-4,4'-dicarboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB48743
ChemicalName
3,3'-Dimethyl-[1,1'-biphenyl]-4,4'-dicarboxylic acid
CasNumber
63297-02-9
MolecularFormula
C16H14O4
MolecularWeight
270.28
MdlNumber
MFCD30542914
Smiles
OC(=O)c1ccc(cc1C)c1ccc(c(c1)C)C(=O)O
Complexity
343
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
3.3
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CatalogNumber: AB48743
ChemicalName: 3,3'-Dimethyl-[1,1'-biphenyl]-4,4'-dicarboxylic acid
CasNumber: 63297-02-9
MolecularFormula: C16H14O4
MolecularWeight: 270.28
MdlNumber: MFCD30542914
Smiles: OC(=O)c1ccc(cc1C)c1ccc(c(c1)C)C(=O)O
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AB48743
ChemicalName:
3,3'-Dimethyl-[1,1'-biphenyl]-4,4'-dicarboxylic acid
CasNumber:
63297-02-9
MolecularFormula:
C16H14O4
MolecularWeight:
270.28
MdlNumber:
MFCD30542914
Smiles:
OC(=O)c1ccc(cc1C)c1ccc(c(c1)C)C(=O)O
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCC(CBr)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCC(CBr)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48745
ChemicalName: 7-Oxabicyclo[4.1.0]heptan-3-ylmethyl acrylate
CasNumber: 64630-63-3
MolecularFormula: C10H14O3
MolecularWeight: 182.2164
MdlNumber: MFCD28364662
Smiles: C=CC(=O)OCC1CCC2C(C1)O2
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 1.6
CatalogNumber:
AB48745
ChemicalName:
7-Oxabicyclo[4.1.0]heptan-3-ylmethyl acrylate
CasNumber:
64630-63-3
MolecularFormula:
C10H14O3
MolecularWeight:
182.2164
MdlNumber:
MFCD28364662
Smiles:
C=CC(=O)OCC1CCC2C(C1)O2
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
1.6
CatalogNumber: AB48746
ChemicalName: 2-(Hydroxymethyl)-5-methoxy-4h-pyran-4-one
CasNumber: 6269-25-6
MolecularFormula: C7H8O4
MolecularWeight: 156.136
MdlNumber: MFCD00224874
Smiles: COc1coc(cc1=O)CO
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: -0.6
CatalogNumber:
AB48746
ChemicalName:
2-(Hydroxymethyl)-5-methoxy-4h-pyran-4-one
CasNumber:
6269-25-6
MolecularFormula:
C7H8O4
MolecularWeight:
156.136
MdlNumber:
MFCD00224874
Smiles:
COc1coc(cc1=O)CO
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
-0.6