AX55139
2096333-99-0 | 3-Nitro-4-(trifluoromethoxy)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55139
ChemicalName
3-Nitro-4-(trifluoromethoxy)phenylboronic acid
CasNumber
2096333-99-0
MolecularFormula
C7H5BF3NO5
MolecularWeight
250.9245
MdlNumber
MFCD21332921
Smiles
[O-][N+](=O)c1cc(ccc1OC(F)(F)F)B(O)O
Complexity
282
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AX55139
ChemicalName: 3-Nitro-4-(trifluoromethoxy)phenylboronic acid
CasNumber: 2096333-99-0
MolecularFormula: C7H5BF3NO5
MolecularWeight: 250.9245
MdlNumber: MFCD21332921
Smiles: [O-][N+](=O)c1cc(ccc1OC(F)(F)F)B(O)O
Complexity: 282
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AX55139
ChemicalName:
3-Nitro-4-(trifluoromethoxy)phenylboronic acid
CasNumber:
2096333-99-0
MolecularFormula:
C7H5BF3NO5
MolecularWeight:
250.9245
MdlNumber:
MFCD21332921
Smiles:
[O-][N+](=O)c1cc(ccc1OC(F)(F)F)B(O)O
Complexity:
282
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N(CCC(=O)O)CCC(=O)O)OCc1ccccc1
Complexity: 347
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N(CCC(=O)O)CCC(=O)O)OCc1ccccc1
Complexity:
347
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(c1sc(cc1Cl)Br)OC
Complexity: 145
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(c1sc(cc1Cl)Br)OC
Complexity:
145
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(c(c1)C)B1OC(C(O1)(C)C)(C)C
Complexity: 287
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(c(c1)C)B1OC(C(O1)(C)C)(C)C
Complexity:
287
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__