AD91024
870245-77-5 | 3-(2-Acetylphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD91024
ChemicalName
3-(2-Acetylphenyl)benzoic acid
CasNumber
870245-77-5
MolecularFormula
C15H12O3
MolecularWeight
240.254
MdlNumber
MFCD06802324
Smiles
OC(=O)c1cccc(c1)c1ccccc1C(=O)C
Complexity
324
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AD91024
ChemicalName: 3-(2-Acetylphenyl)benzoic acid
CasNumber: 870245-77-5
MolecularFormula: C15H12O3
MolecularWeight: 240.254
MdlNumber: MFCD06802324
Smiles: OC(=O)c1cccc(c1)c1ccccc1C(=O)C
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AD91024
ChemicalName:
3-(2-Acetylphenyl)benzoic acid
CasNumber:
870245-77-5
MolecularFormula:
C15H12O3
MolecularWeight:
240.254
MdlNumber:
MFCD06802324
Smiles:
OC(=O)c1cccc(c1)c1ccccc1C(=O)C
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cncc2c1c(N)n[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cncc2c1c(N)n[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc2c(s1)cncc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc2c(s1)cncc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD91033
ChemicalName: 4-(Trimethylsilyl)ethynylphenylboronic acid pinacol ester
CasNumber: 870238-65-6
MolecularFormula: C17H25BO2Si
MolecularWeight: 300.2757
MdlNumber: MFCD08706286
Smiles: C[Si](C#Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(C)C
Complexity: 428
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AD91033
ChemicalName:
4-(Trimethylsilyl)ethynylphenylboronic acid pinacol ester
CasNumber:
870238-65-6
MolecularFormula:
C17H25BO2Si
MolecularWeight:
300.2757
MdlNumber:
MFCD08706286
Smiles:
C[Si](C#Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(C)C
Complexity:
428
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
__