AG17922
473917-15-6 | 3-Fluoro-4-(trifluoromethoxy)benzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AG17922
ChemicalName
3-Fluoro-4-(trifluoromethoxy)benzaldehyde
CasNumber
473917-15-6
MolecularFormula
C8H4F4O2
MolecularWeight
208.1098
MdlNumber
MFCD06660201
Smiles
O=Cc1ccc(c(c1)F)OC(F)(F)F
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
6
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AG17922
ChemicalName: 3-Fluoro-4-(trifluoromethoxy)benzaldehyde
CasNumber: 473917-15-6
MolecularFormula: C8H4F4O2
MolecularWeight: 208.1098
MdlNumber: MFCD06660201
Smiles: O=Cc1ccc(c(c1)F)OC(F)(F)F
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AG17922
ChemicalName:
3-Fluoro-4-(trifluoromethoxy)benzaldehyde
CasNumber:
473917-15-6
MolecularFormula:
C8H4F4O2
MolecularWeight:
208.1098
MdlNumber:
MFCD06660201
Smiles:
O=Cc1ccc(c(c1)F)OC(F)(F)F
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AG17923
ChemicalName: 4-(Boc-amino)-2-bromopyridine
CasNumber: 433711-95-6
MolecularFormula: C10H13BrN2O2
MolecularWeight: 273.1264
MdlNumber: MFCD03791266
Smiles: O=C(OC(C)(C)C)Nc1ccnc(c1)Br
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AG17923
ChemicalName:
4-(Boc-amino)-2-bromopyridine
CasNumber:
433711-95-6
MolecularFormula:
C10H13BrN2O2
MolecularWeight:
273.1264
MdlNumber:
MFCD03791266
Smiles:
O=C(OC(C)(C)C)Nc1ccnc(c1)Br
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: AG17924
ChemicalName: 3,4-Diaminocyclobut-3-ene-1,2-dione
CasNumber: 5231-89-0
MolecularFormula: C4H4N2O2
MolecularWeight: 112.08676
MdlNumber: MFCD00205212
Smiles: NC1=C(N)C(=O)C1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AG17924
ChemicalName:
3,4-Diaminocyclobut-3-ene-1,2-dione
CasNumber:
5231-89-0
MolecularFormula:
C4H4N2O2
MolecularWeight:
112.08676
MdlNumber:
MFCD00205212
Smiles:
NC1=C(N)C(=O)C1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG17925
ChemicalName: Diethyl 4-oxocyclohexane-1,1-dicarboxylate
CasNumber: 55704-60-4
MolecularFormula: C12H18O5
MolecularWeight: 242.26832000000007
MdlNumber: MFCD00177942
Smiles: CCOC(=O)C1(CCC(=O)CC1)C(=O)OCC
Complexity: 291
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
Xlogp3: 0.9
CatalogNumber:
AG17925
ChemicalName:
Diethyl 4-oxocyclohexane-1,1-dicarboxylate
CasNumber:
55704-60-4
MolecularFormula:
C12H18O5
MolecularWeight:
242.26832000000007
MdlNumber:
MFCD00177942
Smiles:
CCOC(=O)C1(CCC(=O)CC1)C(=O)OCC
Complexity:
291
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
Xlogp3:
0.9