AB65652
65412-03-5 | 4-(2-Aminoethyl)tetrahydropyran
Manufacturer: A2B Chem
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CatalogNumber
AB65652
ChemicalName
4-(2-Aminoethyl)tetrahydropyran
CasNumber
65412-03-5
MolecularFormula
C7H15NO
MolecularWeight
129.2001
MdlNumber
MFCD02179433
Smiles
NCCC1CCOCC1
Complexity
69.3
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.2
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CatalogNumber: AB65652
ChemicalName: 4-(2-Aminoethyl)tetrahydropyran
CasNumber: 65412-03-5
MolecularFormula: C7H15NO
MolecularWeight: 129.2001
MdlNumber: MFCD02179433
Smiles: NCCC1CCOCC1
Complexity: 69.3
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.2
CatalogNumber:
AB65652
ChemicalName:
4-(2-Aminoethyl)tetrahydropyran
CasNumber:
65412-03-5
MolecularFormula:
C7H15NO
MolecularWeight:
129.2001
MdlNumber:
MFCD02179433
Smiles:
NCCC1CCOCC1
Complexity:
69.3
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O1CCN(CC1)SSc1nc2c(s1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O1CCN(CC1)SSc1nc2c(s1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB65654
ChemicalName: 4-(2-Bromo-4-nitrophenoxy)tetrahydro-2H-pyran
CasNumber: 1072944-62-7
MolecularFormula: C11H12BrNO4
MolecularWeight: 302.1213
MdlNumber: MFCD11504903
Smiles: Brc1cc(ccc1OC1CCOCC1)[N+](=O)[O-]
Complexity: 265
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AB65654
ChemicalName:
4-(2-Bromo-4-nitrophenoxy)tetrahydro-2H-pyran
CasNumber:
1072944-62-7
MolecularFormula:
C11H12BrNO4
MolecularWeight:
302.1213
MdlNumber:
MFCD11504903
Smiles:
Brc1cc(ccc1OC1CCOCC1)[N+](=O)[O-]
Complexity:
265
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: AB65655
ChemicalName: 4-(2-Bromo-5-(trifluoromethoxy)phenyl)-2-methylbut-3-yn-2-ol
CasNumber: 1187385-74-5
MolecularFormula: C12H10BrF3O2
MolecularWeight: 323.1058
MdlNumber: MFCD12913967
Smiles: Brc1ccc(cc1C#CC(O)(C)C)OC(F)(F)F
Complexity: 353
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.9
CatalogNumber:
AB65655
ChemicalName:
4-(2-Bromo-5-(trifluoromethoxy)phenyl)-2-methylbut-3-yn-2-ol
CasNumber:
1187385-74-5
MolecularFormula:
C12H10BrF3O2
MolecularWeight:
323.1058
MdlNumber:
MFCD12913967
Smiles:
Brc1ccc(cc1C#CC(O)(C)C)OC(F)(F)F
Complexity:
353
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.9