AA49374
136718-78-0 | Ethyl 2-[(3-nitropyridin-2-yl)oxy]acetate
Manufacturer: A2B Chem
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CatalogNumber
AA49374
ChemicalName
Ethyl 2-[(3-nitropyridin-2-yl)oxy]acetate
CasNumber
136718-78-0
MolecularFormula
C9H10N2O5
MolecularWeight
226.1861
MdlNumber
MFCD01648639
Smiles
CCOC(=O)COc1ncccc1[N+](=O)[O-]
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
6
RotatableBondCount
5
Xlogp3
1.3
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CatalogNumber: AA49374
ChemicalName: Ethyl 2-[(3-nitropyridin-2-yl)oxy]acetate
CasNumber: 136718-78-0
MolecularFormula: C9H10N2O5
MolecularWeight: 226.1861
MdlNumber: MFCD01648639
Smiles: CCOC(=O)COc1ncccc1[N+](=O)[O-]
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 6
RotatableBondCount: 5
Xlogp3: 1.3
CatalogNumber:
AA49374
ChemicalName:
Ethyl 2-[(3-nitropyridin-2-yl)oxy]acetate
CasNumber:
136718-78-0
MolecularFormula:
C9H10N2O5
MolecularWeight:
226.1861
MdlNumber:
MFCD01648639
Smiles:
CCOC(=O)COc1ncccc1[N+](=O)[O-]
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
6
RotatableBondCount:
5
Xlogp3:
1.3
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Smiles: Clc1ccc(cc1)c1nnc2-c3c(C(=O)c2c1)cccc3
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Clc1ccc(cc1)c1nnc2-c3c(C(=O)c2c1)cccc3
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: C1CC=CCCC=C1.FC(S(=O)(=O)[O-])(F)F.C[C@H]1CC[C@@H](P1c1ccccc1P1[C@@H](C)CC[C@@H]1C)C.[Rh]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
C1CC=CCCC=C1.FC(S(=O)(=O)[O-])(F)F.C[C@H]1CC[C@@H](P1c1ccccc1P1[C@@H](C)CC[C@@H]1C)C.[Rh]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: CC[C@@H](CC[C@H](CC)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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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:
CC[C@@H](CC[C@H](CC)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__