AH49996
82782-85-2 | Methyl 4h-thieno[3,2-b]pyrrole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AH49996
ChemicalName
Methyl 4h-thieno[3,2-b]pyrrole-5-carboxylate
CasNumber
82782-85-2
MolecularFormula
C8H7NO2S
MolecularWeight
181.2117
MdlNumber
MFCD06797484
Smiles
COC(=O)c1cc2c([nH]1)ccs2
Complexity
198
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AH49996
ChemicalName: Methyl 4h-thieno[3,2-b]pyrrole-5-carboxylate
CasNumber: 82782-85-2
MolecularFormula: C8H7NO2S
MolecularWeight: 181.2117
MdlNumber: MFCD06797484
Smiles: COC(=O)c1cc2c([nH]1)ccs2
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AH49996
ChemicalName:
Methyl 4h-thieno[3,2-b]pyrrole-5-carboxylate
CasNumber:
82782-85-2
MolecularFormula:
C8H7NO2S
MolecularWeight:
181.2117
MdlNumber:
MFCD06797484
Smiles:
COC(=O)c1cc2c([nH]1)ccs2
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: OC(=O)C1CCN(CC1)c1ncccc1[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)C1CCN(CC1)c1ncccc1[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: COC(=O)CCC(C(=O)OC)Br
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)CCC(C(=O)OC)Br
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCCCCCC(CCCCCCCCCCC(=O)OCC)O
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Smiles:
CCCCCCC(CCCCCCCCCCC(=O)OCC)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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