AD41711
34793-28-7 | 3-(1H-Imidazol-1-yl)propane-1,2-diol
Manufacturer: A2B Chem
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CatalogNumber
AD41711
ChemicalName
3-(1H-Imidazol-1-yl)propane-1,2-diol
CasNumber
34793-28-7
MolecularFormula
C6H10N2O2
MolecularWeight
142.1558
MdlNumber
MFCD09834375
Smiles
OCC(Cn1cncc1)O
Complexity
99.7
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
-1.4
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CatalogNumber: AD41711
ChemicalName: 3-(1H-Imidazol-1-yl)propane-1,2-diol
CasNumber: 34793-28-7
MolecularFormula: C6H10N2O2
MolecularWeight: 142.1558
MdlNumber: MFCD09834375
Smiles: OCC(Cn1cncc1)O
Complexity: 99.7
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: -1.4
CatalogNumber:
AD41711
ChemicalName:
3-(1H-Imidazol-1-yl)propane-1,2-diol
CasNumber:
34793-28-7
MolecularFormula:
C6H10N2O2
MolecularWeight:
142.1558
MdlNumber:
MFCD09834375
Smiles:
OCC(Cn1cncc1)O
Complexity:
99.7
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
-1.4
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Smiles: CN(CCc1ccccc1N)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
CN(CCc1ccccc1N)C
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: [O-]/C(=C/1C(=O)C2(C(C1CC2)(C)C)C)/C(C(C(F)(F)F)(F)F)(F)F.[O-]/C(=C/1C(=O)C2(C(C1CC2)(C)C)C)/C(C(C(F)(F)F)(F)F)(F)F.[O-]/C(=C/1C(=O)C2(C(C1CC2)(C)C)C)/C(C(C(F)(F)F)(F)F)(F)F.[Eu+3]
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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__
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Smiles:
[O-]/C(=C/1C(=O)C2(C(C1CC2)(C)C)C)/C(C(C(F)(F)F)(F)F)(F)F.[O-]/C(=C/1C(=O)C2(C(C1CC2)(C)C)C)/C(C(C(F)(F)F)(F)F)(F)F.[O-]/C(=C/1C(=O)C2(C(C1CC2)(C)C)C)/C(C(C(F)(F)F)(F)F)(F)F.[Eu+3]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Cc1ccc(s1)CCl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(s1)CCl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__