AI60868
910301-32-5 | 1,3-Difluoro-5-(4-nitrophenyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AI60868
ChemicalName
1,3-Difluoro-5-(4-nitrophenyl)benzene
CasNumber
910301-32-5
MolecularFormula
C12H7F2NO2
MolecularWeight
235.1863
MdlNumber
MFCD20529498
Smiles
Fc1cc(cc(c1)F)c1ccc(cc1)[N+](=O)[O-]
Complexity
264
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
3.6
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CatalogNumber: AI60868
ChemicalName: 1,3-Difluoro-5-(4-nitrophenyl)benzene
CasNumber: 910301-32-5
MolecularFormula: C12H7F2NO2
MolecularWeight: 235.1863
MdlNumber: MFCD20529498
Smiles: Fc1cc(cc(c1)F)c1ccc(cc1)[N+](=O)[O-]
Complexity: 264
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 3.6
CatalogNumber:
AI60868
ChemicalName:
1,3-Difluoro-5-(4-nitrophenyl)benzene
CasNumber:
910301-32-5
MolecularFormula:
C12H7F2NO2
MolecularWeight:
235.1863
MdlNumber:
MFCD20529498
Smiles:
Fc1cc(cc(c1)F)c1ccc(cc1)[N+](=O)[O-]
Complexity:
264
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
3.6
CatalogNumber: AI60869
ChemicalName: (S)-Beta-(boc-amino)-3-bromobenzeneethanol
CasNumber: 910308-92-8
MolecularFormula: C13H18BrNO3
MolecularWeight: 316.19091999999995
MdlNumber: MFCD27952001
Smiles: OC[C@H](c1cccc(c1)Br)NC(=O)OC(C)(C)C
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AI60869
ChemicalName:
(S)-Beta-(boc-amino)-3-bromobenzeneethanol
CasNumber:
910308-92-8
MolecularFormula:
C13H18BrNO3
MolecularWeight:
316.19091999999995
MdlNumber:
MFCD27952001
Smiles:
OC[C@H](c1cccc(c1)Br)NC(=O)OC(C)(C)C
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C1(C)COCCC1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C1(C)COCCC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCc1cc(OC)ccc1Br
Complexity: 132
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCc1cc(OC)ccc1Br
Complexity:
132
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9