AI56002
756484-20-5 | 4-Acetyl-3'-(benzyloxy)biphenyl
Manufacturer: A2B Chem
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CatalogNumber
AI56002
ChemicalName
4-Acetyl-3'-(benzyloxy)biphenyl
CasNumber
756484-20-5
MolecularFormula
C21H18O2
MolecularWeight
302.3664
MdlNumber
MFCD06802279
Smiles
CC(=O)c1ccc(cc1)c1cccc(c1)OCc1ccccc1
Complexity
364
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
2
RotatableBondCount
5
Xlogp3
4.8
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CatalogNumber: AI56002
ChemicalName: 4-Acetyl-3'-(benzyloxy)biphenyl
CasNumber: 756484-20-5
MolecularFormula: C21H18O2
MolecularWeight: 302.3664
MdlNumber: MFCD06802279
Smiles: CC(=O)c1ccc(cc1)c1cccc(c1)OCc1ccccc1
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 2
RotatableBondCount: 5
Xlogp3: 4.8
CatalogNumber:
AI56002
ChemicalName:
4-Acetyl-3'-(benzyloxy)biphenyl
CasNumber:
756484-20-5
MolecularFormula:
C21H18O2
MolecularWeight:
302.3664
MdlNumber:
MFCD06802279
Smiles:
CC(=O)c1ccc(cc1)c1cccc(c1)OCc1ccccc1
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
2
RotatableBondCount:
5
Xlogp3:
4.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(ccc1OC)/C=C(C(=O)O)/NC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(ccc1OC)/C=C(C(=O)O)/NC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI56004
ChemicalName: Phenyl (4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate
CasNumber: 756520-47-5
MolecularFormula: C19H22BNO4
MolecularWeight: 339.1933
MdlNumber: MFCD20527213
Smiles: O=C(Oc1ccccc1)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 452
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: __
CatalogNumber:
AI56004
ChemicalName:
Phenyl (4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate
CasNumber:
756520-47-5
MolecularFormula:
C19H22BNO4
MolecularWeight:
339.1933
MdlNumber:
MFCD20527213
Smiles:
O=C(Oc1ccccc1)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
452
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
__
CatalogNumber: AI56005
ChemicalName: 4-(1,1-Dioxido-2-isothiazolidinyl)phenylboronic acid pinacol ester
CasNumber: 756520-72-6
MolecularFormula: C15H22BNO4S
MolecularWeight: 323.2155
MdlNumber: MFCD26937568
Smiles: O=S1(=O)CCCN1c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 504
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AI56005
ChemicalName:
4-(1,1-Dioxido-2-isothiazolidinyl)phenylboronic acid pinacol ester
CasNumber:
756520-72-6
MolecularFormula:
C15H22BNO4S
MolecularWeight:
323.2155
MdlNumber:
MFCD26937568
Smiles:
O=S1(=O)CCCN1c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
504
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
__