AB64945
1214323-11-1 | 3-Fluoro-2-nitrobenzyl alcohol
Manufacturer: A2B Chem
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CatalogNumber
AB64945
ChemicalName
3-Fluoro-2-nitrobenzyl alcohol
CasNumber
1214323-11-1
MolecularFormula
C7H6FNO3
MolecularWeight
171.1258
MdlNumber
MFCD13185620
Smiles
OCc1cccc(c1[N+](=O)[O-])F
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1
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CatalogNumber: AB64945
ChemicalName: 3-Fluoro-2-nitrobenzyl alcohol
CasNumber: 1214323-11-1
MolecularFormula: C7H6FNO3
MolecularWeight: 171.1258
MdlNumber: MFCD13185620
Smiles: OCc1cccc(c1[N+](=O)[O-])F
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AB64945
ChemicalName:
3-Fluoro-2-nitrobenzyl alcohol
CasNumber:
1214323-11-1
MolecularFormula:
C7H6FNO3
MolecularWeight:
171.1258
MdlNumber:
MFCD13185620
Smiles:
OCc1cccc(c1[N+](=O)[O-])F
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: AB64946
ChemicalName: 3-Fluoropyridine-4-boronic acid, pinacol ester
CasNumber: 458532-88-2
MolecularFormula: C11H15BFNO2
MolecularWeight: 223.0517
MdlNumber: MFCD06798251
Smiles: Fc1cnccc1B1OC(C(O1)(C)C)(C)C
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB64946
ChemicalName:
3-Fluoropyridine-4-boronic acid, pinacol ester
CasNumber:
458532-88-2
MolecularFormula:
C11H15BFNO2
MolecularWeight:
223.0517
MdlNumber:
MFCD06798251
Smiles:
Fc1cnccc1B1OC(C(O1)(C)C)(C)C
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: AB64947
ChemicalName: 3-Fluoro-4-methylsulfonylbenzoic acid
CasNumber: 185945-88-4
MolecularFormula: C8H7FO4S
MolecularWeight: 218.2022
MdlNumber: MFCD09743730
Smiles: OC(=O)c1ccc(c(c1)F)S(=O)(=O)C
Complexity: 319
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AB64947
ChemicalName:
3-Fluoro-4-methylsulfonylbenzoic acid
CasNumber:
185945-88-4
MolecularFormula:
C8H7FO4S
MolecularWeight:
218.2022
MdlNumber:
MFCD09743730
Smiles:
OC(=O)c1ccc(c(c1)F)S(=O)(=O)C
Complexity:
319
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.8
CatalogNumber: AB64948
ChemicalName: 3-Fluoro-4-(methylsulfonyl)phenylboronic acid
CasNumber: 648904-83-0
MolecularFormula: C7H8BFO4S
MolecularWeight: 218.01042320000002
MdlNumber: MFCD09878323
Smiles: OB(c1ccc(c(c1)F)S(=O)(=O)C)O
Complexity: 287
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB64948
ChemicalName:
3-Fluoro-4-(methylsulfonyl)phenylboronic acid
CasNumber:
648904-83-0
MolecularFormula:
C7H8BFO4S
MolecularWeight:
218.01042320000002
MdlNumber:
MFCD09878323
Smiles:
OB(c1ccc(c(c1)F)S(=O)(=O)C)O
Complexity:
287
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
__