AB48664
96516-29-9 | 2-Fluoro-3-nitrobenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB48664
ChemicalName
2-Fluoro-3-nitrobenzaldehyde
CasNumber
96516-29-9
MolecularFormula
C7H4FNO3
MolecularWeight
169.11
MdlNumber
MFCD08669885
Smiles
O=Cc1cccc(c1F)[N+](=O)[O-]
Complexity
192
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
1.3
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CatalogNumber: AB48664
ChemicalName: 2-Fluoro-3-nitrobenzaldehyde
CasNumber: 96516-29-9
MolecularFormula: C7H4FNO3
MolecularWeight: 169.11
MdlNumber: MFCD08669885
Smiles: O=Cc1cccc(c1F)[N+](=O)[O-]
Complexity: 192
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AB48664
ChemicalName:
2-Fluoro-3-nitrobenzaldehyde
CasNumber:
96516-29-9
MolecularFormula:
C7H4FNO3
MolecularWeight:
169.11
MdlNumber:
MFCD08669885
Smiles:
O=Cc1cccc(c1F)[N+](=O)[O-]
Complexity:
192
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: AB48665
ChemicalName: (10R,11R,15R,16S)-16-hydroxy-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one
CasNumber: 6559-91-7
MolecularFormula: C21H20O8
MolecularWeight: 400.3787
MdlNumber: MFCD00189421
Smiles: COc1cc(cc(c1O)OC)[C@H]1[C@H]2C(=O)OC[C@@H]2[C@@H](c2c1cc1OCOc1c2)O
Complexity: 614
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 8
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AB48665
ChemicalName:
(10R,11R,15R,16S)-16-hydroxy-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0^{3,7}.0^{11,15}]hexadeca-1,3(7),8-trien-12-one
CasNumber:
6559-91-7
MolecularFormula:
C21H20O8
MolecularWeight:
400.3787
MdlNumber:
MFCD00189421
Smiles:
COc1cc(cc(c1O)OC)[C@H]1[C@H]2C(=O)OC[C@@H]2[C@@H](c2c1cc1OCOc1c2)O
Complexity:
614
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
8
RotatableBondCount:
3
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: S=C1NCCN1
Complexity: 63.2
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -0.7
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
S=C1NCCN1
Complexity:
63.2
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CCN([C@H]1CC(=C[C@H]([C@@H]1N(C(C)(C)C)C(=O)C)OC(CC)CC)C(=O)OCC)CC=C.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
C=CCN([C@H]1CC(=C[C@H]([C@@H]1N(C(C)(C)C)C(=O)C)OC(CC)CC)C(=O)OCC)CC=C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__