AG20171
51718-80-0 | methyl 2-(3H-imidazol-4-yl)acetate hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AG20171
ChemicalName
methyl 2-(3H-imidazol-4-yl)acetate hydrochloride
CasNumber
51718-80-0
MolecularFormula
C6H9ClN2O2
MolecularWeight
176.6009
MdlNumber
MFCD08275082
Smiles
COC(=O)Cc1c[nH]cn1.Cl
Complexity
127
Covalently-bondedUnitCount
2
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AG20171
ChemicalName: methyl 2-(3H-imidazol-4-yl)acetate hydrochloride
CasNumber: 51718-80-0
MolecularFormula: C6H9ClN2O2
MolecularWeight: 176.6009
MdlNumber: MFCD08275082
Smiles: COC(=O)Cc1c[nH]cn1.Cl
Complexity: 127
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AG20171
ChemicalName:
methyl 2-(3H-imidazol-4-yl)acetate hydrochloride
CasNumber:
51718-80-0
MolecularFormula:
C6H9ClN2O2
MolecularWeight:
176.6009
MdlNumber:
MFCD08275082
Smiles:
COC(=O)Cc1c[nH]cn1.Cl
Complexity:
127
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
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MolecularFormula: __
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Smiles: Cc1cc(cc(c1N)[N+](=O)[O-])N1CCOCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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Smiles:
Cc1cc(cc(c1N)[N+](=O)[O-])N1CCOCC1
Complexity:
__
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: BrCc1cc(ccc1Cl)[N+](=O)[O-]
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Smiles:
BrCc1cc(ccc1Cl)[N+](=O)[O-]
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COC(=O)c1nc(cn1C)NC(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)c1nc(cn1C)NC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__