AI55004
68890-66-4 | Piroctone olamine
Manufacturer: A2B Chem
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CatalogNumber
AI55004
ChemicalName
Piroctone olamine
CasNumber
68890-66-4
MolecularFormula
C16H30N2O3
MolecularWeight
298.421
MdlNumber
MFCD01690792
Smiles
CC(CC(C)(C)C)Cc1cc(C)cc(=O)n1O.NCCO
Complexity
371
Covalently-bondedUnitCount
2
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
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CatalogNumber: AI55004
ChemicalName: Piroctone olamine
CasNumber: 68890-66-4
MolecularFormula: C16H30N2O3
MolecularWeight: 298.421
MdlNumber: MFCD01690792
Smiles: CC(CC(C)(C)C)Cc1cc(C)cc(=O)n1O.NCCO
Complexity: 371
Covalently-bondedUnitCount: 2
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AI55004
ChemicalName:
Piroctone olamine
CasNumber:
68890-66-4
MolecularFormula:
C16H30N2O3
MolecularWeight:
298.421
MdlNumber:
MFCD01690792
Smiles:
CC(CC(C)(C)C)Cc1cc(C)cc(=O)n1O.NCCO
Complexity:
371
Covalently-bondedUnitCount:
2
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
CatalogNumber: AI55005
ChemicalName: N2-Isobutyryl-2'-deoxyguanosine
CasNumber: 68892-42-2
MolecularFormula: C14H19N5O5
MolecularWeight: 337.33115999999984
MdlNumber: MFCD00010060
Smiles: OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1[nH]c(NC(=O)C(C)C)nc2=O
Complexity: 554
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 4
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
CatalogNumber:
AI55005
ChemicalName:
N2-Isobutyryl-2'-deoxyguanosine
CasNumber:
68892-42-2
MolecularFormula:
C14H19N5O5
MolecularWeight:
337.33115999999984
MdlNumber:
MFCD00010060
Smiles:
OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1[nH]c(NC(=O)C(C)C)nc2=O
Complexity:
554
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
4
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(NC(=O)N)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(NC(=O)N)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: AI55007
ChemicalName: Galbanum oxyacetate
CasNumber: 68901-15-5
MolecularFormula: C11H18O3
MolecularWeight: 198.2588200000001
MdlNumber: MFCD00083564
Smiles: C=CCOC(=O)COC1CCCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
AI55007
ChemicalName:
Galbanum oxyacetate
CasNumber:
68901-15-5
MolecularFormula:
C11H18O3
MolecularWeight:
198.2588200000001
MdlNumber:
MFCD00083564
Smiles:
C=CCOC(=O)COC1CCCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__