AB44070
90259-27-1 | 2-Fluoro-6-methylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB44070
ChemicalName
2-Fluoro-6-methylbenzoic acid
CasNumber
90259-27-1
MolecularFormula
C8H7FO2
MolecularWeight
154.1384
MdlNumber
MFCD06658162
Smiles
OC(=O)c1c(C)cccc1F
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.8
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CatalogNumber: AB44070
ChemicalName: 2-Fluoro-6-methylbenzoic acid
CasNumber: 90259-27-1
MolecularFormula: C8H7FO2
MolecularWeight: 154.1384
MdlNumber: MFCD06658162
Smiles: OC(=O)c1c(C)cccc1F
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AB44070
ChemicalName:
2-Fluoro-6-methylbenzoic acid
CasNumber:
90259-27-1
MolecularFormula:
C8H7FO2
MolecularWeight:
154.1384
MdlNumber:
MFCD06658162
Smiles:
OC(=O)c1c(C)cccc1F
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cccc(c1C(=O)O)F
Complexity: 227
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cccc(c1C(=O)O)F
Complexity:
227
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: AB44072
ChemicalName: 1-Fluoro-2-methyl-3-nitrobenzene
CasNumber: 769-10-8
MolecularFormula: C7H6FNO2
MolecularWeight: 155.1264
MdlNumber: MFCD00007197
Smiles: [O-][N+](=O)c1cccc(c1C)F
Complexity: 157
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
AB44072
ChemicalName:
1-Fluoro-2-methyl-3-nitrobenzene
CasNumber:
769-10-8
MolecularFormula:
C7H6FNO2
MolecularWeight:
155.1264
MdlNumber:
MFCD00007197
Smiles:
[O-][N+](=O)c1cccc(c1C)F
Complexity:
157
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: AB44073
ChemicalName: 2-Fluoroadenine
CasNumber: 700-49-2
MolecularFormula: C5H4FN5
MolecularWeight: 153.1172
MdlNumber: MFCD01632749
Smiles: Fc1nc(N)c2c(n1)nc[nH]2
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: -0.1
CatalogNumber:
AB44073
ChemicalName:
2-Fluoroadenine
CasNumber:
700-49-2
MolecularFormula:
C5H4FN5
MolecularWeight:
153.1172
MdlNumber:
MFCD01632749
Smiles:
Fc1nc(N)c2c(n1)nc[nH]2
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
-0.1