AA02710
1005207-32-8 | 4-Benzylthiophenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA02710
ChemicalName
4-Benzylthiophenylboronic acid
CasNumber
1005207-32-8
MolecularFormula
C13H13BO2S
MolecularWeight
244.11712000000003
MdlNumber
MFCD06801692
Smiles
OB(c1ccc(cc1)SCc1ccccc1)O
Complexity
212
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AA02710
ChemicalName: 4-Benzylthiophenylboronic acid
CasNumber: 1005207-32-8
MolecularFormula: C13H13BO2S
MolecularWeight: 244.11712000000003
MdlNumber: MFCD06801692
Smiles: OB(c1ccc(cc1)SCc1ccccc1)O
Complexity: 212
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AA02710
ChemicalName:
4-Benzylthiophenylboronic acid
CasNumber:
1005207-32-8
MolecularFormula:
C13H13BO2S
MolecularWeight:
244.11712000000003
MdlNumber:
MFCD06801692
Smiles:
OB(c1ccc(cc1)SCc1ccccc1)O
Complexity:
212
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AA02711
ChemicalName: 4-trifluoromethylthiophenylboronic acid pinacol ester
CasNumber: 1005206-25-6
MolecularFormula: C13H16BF3O2S
MolecularWeight: 304.1361
MdlNumber: MFCD11042448
Smiles: FC(Sc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(F)F
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AA02711
ChemicalName:
4-trifluoromethylthiophenylboronic acid pinacol ester
CasNumber:
1005206-25-6
MolecularFormula:
C13H16BF3O2S
MolecularWeight:
304.1361
MdlNumber:
MFCD11042448
Smiles:
FC(Sc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(F)F
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
__
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ncnc2c1cc[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ncnc2c1cc[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(NC(=NC(C)C)OC1CCCCC1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(NC(=NC(C)C)OC1CCCCC1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__