AX13355
1956310-57-8 | Ethyl 2-(5-bromo-2-nitrothiophen-3-yl)acetate
Manufacturer: A2B Chem
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CatalogNumber
AX13355
ChemicalName
Ethyl 2-(5-bromo-2-nitrothiophen-3-yl)acetate
CasNumber
1956310-57-8
MolecularFormula
C8H8BrNO4S
MolecularWeight
294.1224
MdlNumber
MFCD21362359
Smiles
[O-][N+](=O)c1sc(cc1CC(=O)OCC)Br
Complexity
258
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
2.9
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CatalogNumber: AX13355
ChemicalName: Ethyl 2-(5-bromo-2-nitrothiophen-3-yl)acetate
CasNumber: 1956310-57-8
MolecularFormula: C8H8BrNO4S
MolecularWeight: 294.1224
MdlNumber: MFCD21362359
Smiles: [O-][N+](=O)c1sc(cc1CC(=O)OCC)Br
Complexity: 258
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AX13355
ChemicalName:
Ethyl 2-(5-bromo-2-nitrothiophen-3-yl)acetate
CasNumber:
1956310-57-8
MolecularFormula:
C8H8BrNO4S
MolecularWeight:
294.1224
MdlNumber:
MFCD21362359
Smiles:
[O-][N+](=O)c1sc(cc1CC(=O)OCC)Br
Complexity:
258
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
2.9
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Smiles: O=c1nc([nH]c2c1CCCC2)c1ccc(cc1)C(F)(F)F
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
O=c1nc([nH]c2c1CCCC2)c1ccc(cc1)C(F)(F)F
Complexity:
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Smiles: CC(C(=O)O)N(CC1=CC=CC=C1)NC(=O)OC(C)(C)C
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CC(C(=O)O)N(CC1=CC=CC=C1)NC(=O)OC(C)(C)C
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Smiles: ClCC1OCCN(C1)Cc1c(Cl)cccc1Cl
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Smiles:
ClCC1OCCN(C1)Cc1c(Cl)cccc1Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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