AI64844
958451-72-4 | 4-Difluoromethoxy-3-methyl-benzeneboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AI64844
ChemicalName
4-Difluoromethoxy-3-methyl-benzeneboronic acid
CasNumber
958451-72-4
MolecularFormula
C8H9BF2O3
MolecularWeight
201.9631
MdlNumber
MFCD11036079
Smiles
FC(Oc1ccc(cc1C)B(O)O)F
Complexity
180
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AI64844
ChemicalName: 4-Difluoromethoxy-3-methyl-benzeneboronic acid
CasNumber: 958451-72-4
MolecularFormula: C8H9BF2O3
MolecularWeight: 201.9631
MdlNumber: MFCD11036079
Smiles: FC(Oc1ccc(cc1C)B(O)O)F
Complexity: 180
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AI64844
ChemicalName:
4-Difluoromethoxy-3-methyl-benzeneboronic acid
CasNumber:
958451-72-4
MolecularFormula:
C8H9BF2O3
MolecularWeight:
201.9631
MdlNumber:
MFCD11036079
Smiles:
FC(Oc1ccc(cc1C)B(O)O)F
Complexity:
180
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AI64845
ChemicalName: 1,4-Dithia-7-azaspiro[4.4]nonane, HCl
CasNumber: 958451-81-5
MolecularFormula: C6H12ClNS2
MolecularWeight: 197.7492
MdlNumber: MFCD11036094
Smiles: C1NCC2(C1)SCCS2.Cl
Complexity: 110
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: __
CatalogNumber:
AI64845
ChemicalName:
1,4-Dithia-7-azaspiro[4.4]nonane, HCl
CasNumber:
958451-81-5
MolecularFormula:
C6H12ClNS2
MolecularWeight:
197.7492
MdlNumber:
MFCD11036094
Smiles:
C1NCC2(C1)SCCS2.Cl
Complexity:
110
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CCC2(CN1)SCCS2.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CCC2(CN1)SCCS2.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cccc2c1sc(c2)B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cccc2c1sc(c2)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__