AI32489
1363210-25-6 | (4,5,6,7-Tetrahydrobenzo[c]isoxazol-3-yl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AI32489
ChemicalName
(4,5,6,7-Tetrahydrobenzo[c]isoxazol-3-yl)methanol
CasNumber
1363210-25-6
MolecularFormula
C8H11NO2
MolecularWeight
153.1784
MdlNumber
MFCD23378487
Smiles
OCc1onc2c1CCCC2
Complexity
140
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.7
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CatalogNumber: AI32489
ChemicalName: (4,5,6,7-Tetrahydrobenzo[c]isoxazol-3-yl)methanol
CasNumber: 1363210-25-6
MolecularFormula: C8H11NO2
MolecularWeight: 153.1784
MdlNumber: MFCD23378487
Smiles: OCc1onc2c1CCCC2
Complexity: 140
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AI32489
ChemicalName:
(4,5,6,7-Tetrahydrobenzo[c]isoxazol-3-yl)methanol
CasNumber:
1363210-25-6
MolecularFormula:
C8H11NO2
MolecularWeight:
153.1784
MdlNumber:
MFCD23378487
Smiles:
OCc1onc2c1CCCC2
Complexity:
140
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1c(C)noc1CCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1c(C)noc1CCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI32491
ChemicalName: 8-tert-Butyl 2-methyl 8-azaspiro[4.5]dec-1-ene-2,8-dicarboxylate
CasNumber: 1363210-32-5
MolecularFormula: C16H25NO4
MolecularWeight: 295.374
MdlNumber: MFCD22209685
Smiles: COC(=O)C1=CC2(CC1)CCN(CC2)C(=O)OC(C)(C)C
Complexity: 453
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 2.7
CatalogNumber:
AI32491
ChemicalName:
8-tert-Butyl 2-methyl 8-azaspiro[4.5]dec-1-ene-2,8-dicarboxylate
CasNumber:
1363210-32-5
MolecularFormula:
C16H25NO4
MolecularWeight:
295.374
MdlNumber:
MFCD22209685
Smiles:
COC(=O)C1=CC2(CC1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
453
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCc1n[nH]c2c1CCC2.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCc1n[nH]c2c1CCC2.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__