AI37506
1563741-43-4 | Ethyl (2E)-3-(2-fluoropyridin-3-yl)prop-2-enoate
Manufacturer: A2B Chem
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CatalogNumber
AI37506
ChemicalName
Ethyl (2E)-3-(2-fluoropyridin-3-yl)prop-2-enoate
CasNumber
1563741-43-4
MolecularFormula
C10H10FNO2
MolecularWeight
195.1903
MdlNumber
MFCD26711919
Smiles
CCOC(=O)/C=C/c1cccnc1F
Complexity
218
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
4
UndefinedBondStereocenterCount
1
Xlogp3
1.9
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CatalogNumber: AI37506
ChemicalName: Ethyl (2E)-3-(2-fluoropyridin-3-yl)prop-2-enoate
CasNumber: 1563741-43-4
MolecularFormula: C10H10FNO2
MolecularWeight: 195.1903
MdlNumber: MFCD26711919
Smiles: CCOC(=O)/C=C/c1cccnc1F
Complexity: 218
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
UndefinedBondStereocenterCount: 1
Xlogp3: 1.9
CatalogNumber:
AI37506
ChemicalName:
Ethyl (2E)-3-(2-fluoropyridin-3-yl)prop-2-enoate
CasNumber:
1563741-43-4
MolecularFormula:
C10H10FNO2
MolecularWeight:
195.1903
MdlNumber:
MFCD26711919
Smiles:
CCOC(=O)/C=C/c1cccnc1F
Complexity:
218
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
UndefinedBondStereocenterCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N/N=C(/c1ccncc1Cl)N
Complexity: 159
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: 0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N/N=C(/c1ccncc1Cl)N
Complexity:
159
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC([C@H](c1ccccc1)N)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC([C@H](c1ccccc1)N)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1scc(c1N)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1scc(c1N)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__