AD78472
105658-49-9 | 3-(3-Methylisoxazol-5-yl)propan-1-ol
Manufacturer: A2B Chem
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CatalogNumber
AD78472
ChemicalName
3-(3-Methylisoxazol-5-yl)propan-1-ol
CasNumber
105658-49-9
MolecularFormula
C7H11NO2
MolecularWeight
141.16774
MdlNumber
MFCD04972527
Smiles
Cc1cc(on1)CCCO
Complexity
97.6
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.7
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CatalogNumber: AD78472
ChemicalName: 3-(3-Methylisoxazol-5-yl)propan-1-ol
CasNumber: 105658-49-9
MolecularFormula: C7H11NO2
MolecularWeight: 141.16774
MdlNumber: MFCD04972527
Smiles: Cc1cc(on1)CCCO
Complexity: 97.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.7
CatalogNumber:
AD78472
ChemicalName:
3-(3-Methylisoxazol-5-yl)propan-1-ol
CasNumber:
105658-49-9
MolecularFormula:
C7H11NO2
MolecularWeight:
141.16774
MdlNumber:
MFCD04972527
Smiles:
Cc1cc(on1)CCCO
Complexity:
97.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CNS(=O)(=O)c1ccc(cc1)C
Complexity: 312
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CNS(=O)(=O)c1ccc(cc1)C
Complexity:
312
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: SC(=S)NC#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
SC(=S)NC#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1Oc2cc(O)cc(c2C(C1)c1ccccc1)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1Oc2cc(O)cc(c2C(C1)c1ccccc1)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__