AI61107
91319-50-5 | (E)-Ethyl 3-(2-fluoro-5-nitrophenyl)acrylate
Manufacturer: A2B Chem
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CatalogNumber
AI61107
ChemicalName
(E)-Ethyl 3-(2-fluoro-5-nitrophenyl)acrylate
CasNumber
91319-50-5
MolecularFormula
C11H10FNO4
MolecularWeight
239.19980320000002
MdlNumber
MFCD22124782
Smiles
[O-][N+](=O)c1cc(/C=C/C(=O)OCC)c(cc1)F
Complexity
313
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
2.5
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CatalogNumber: AI61107
ChemicalName: (E)-Ethyl 3-(2-fluoro-5-nitrophenyl)acrylate
CasNumber: 91319-50-5
MolecularFormula: C11H10FNO4
MolecularWeight: 239.19980320000002
MdlNumber: MFCD22124782
Smiles: [O-][N+](=O)c1cc(/C=C/C(=O)OCC)c(cc1)F
Complexity: 313
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 2.5
CatalogNumber:
AI61107
ChemicalName:
(E)-Ethyl 3-(2-fluoro-5-nitrophenyl)acrylate
CasNumber:
91319-50-5
MolecularFormula:
C11H10FNO4
MolecularWeight:
239.19980320000002
MdlNumber:
MFCD22124782
Smiles:
[O-][N+](=O)c1cc(/C=C/C(=O)OCC)c(cc1)F
Complexity:
313
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(CCCO)c(cc1)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
[O-][N+](=O)c1cc(CCCO)c(cc1)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI61109
ChemicalName: [4-[[(4-Methylphenyl)amino]-carbonyl]phenyl]boronic acid
CasNumber: 913198-24-0
MolecularFormula: C14H14BNO3
MolecularWeight: 255.07686
MdlNumber: MFCD20527100
Smiles: Cc1ccc(cc1)NC(=O)c1ccc(cc1)B(O)O
Complexity: 295
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AI61109
ChemicalName:
[4-[[(4-Methylphenyl)amino]-carbonyl]phenyl]boronic acid
CasNumber:
913198-24-0
MolecularFormula:
C14H14BNO3
MolecularWeight:
255.07686
MdlNumber:
MFCD20527100
Smiles:
Cc1ccc(cc1)NC(=O)c1ccc(cc1)B(O)O
Complexity:
295
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__