AB49914
21733-03-9 | 5-Chloro-1H-1,2,4-triazole-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB49914
ChemicalName
5-Chloro-1H-1,2,4-triazole-3-carboxylic acid
CasNumber
21733-03-9
MolecularFormula
C3H2ClN3O2
MolecularWeight
147.5199
MdlNumber
MFCD11040183
Smiles
OC(=O)c1nnc([nH]1)Cl
Complexity
130
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.8
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CatalogNumber: AB49914
ChemicalName: 5-Chloro-1H-1,2,4-triazole-3-carboxylic acid
CasNumber: 21733-03-9
MolecularFormula: C3H2ClN3O2
MolecularWeight: 147.5199
MdlNumber: MFCD11040183
Smiles: OC(=O)c1nnc([nH]1)Cl
Complexity: 130
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AB49914
ChemicalName:
5-Chloro-1H-1,2,4-triazole-3-carboxylic acid
CasNumber:
21733-03-9
MolecularFormula:
C3H2ClN3O2
MolecularWeight:
147.5199
MdlNumber:
MFCD11040183
Smiles:
OC(=O)c1nnc([nH]1)Cl
Complexity:
130
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: ClCO[Si](C(C)C)(C(C)C)C(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
ClCO[Si](C(C)C)(C(C)C)C(C)C
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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ChemicalName: __
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MolecularFormula: __
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Smiles: Brc1ccc(cc1)c1ccon1
Complexity: __
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Smiles:
Brc1ccc(cc1)c1ccon1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: ClCOC(=O)Cl
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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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:
ClCOC(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__