AB50876
64001-06-5 | 4-((Tetrahydrofuran-2-yl)oxy)butan-1-ol
Manufacturer: A2B Chem
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CatalogNumber
AB50876
ChemicalName
4-((Tetrahydrofuran-2-yl)oxy)butan-1-ol
CasNumber
64001-06-5
MolecularFormula
C8H16O3
MolecularWeight
160.2108
MdlNumber
MFCD18976725
Smiles
OCCCCOC1CCCO1
Complexity
95.3
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
0.6
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CatalogNumber: AB50876
ChemicalName: 4-((Tetrahydrofuran-2-yl)oxy)butan-1-ol
CasNumber: 64001-06-5
MolecularFormula: C8H16O3
MolecularWeight: 160.2108
MdlNumber: MFCD18976725
Smiles: OCCCCOC1CCCO1
Complexity: 95.3
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.6
CatalogNumber:
AB50876
ChemicalName:
4-((Tetrahydrofuran-2-yl)oxy)butan-1-ol
CasNumber:
64001-06-5
MolecularFormula:
C8H16O3
MolecularWeight:
160.2108
MdlNumber:
MFCD18976725
Smiles:
OCCCCOC1CCCO1
Complexity:
95.3
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.6
CatalogNumber: AB50877
ChemicalName: 3-Bromopropionamide
CasNumber: 6320-96-3
MolecularFormula: C3H6BrNO
MolecularWeight: 151.9898
MdlNumber: MFCD00143100
Smiles: NC(=O)CCBr
Complexity: 54.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: -0.2
CatalogNumber:
AB50877
ChemicalName:
3-Bromopropionamide
CasNumber:
6320-96-3
MolecularFormula:
C3H6BrNO
MolecularWeight:
151.9898
MdlNumber:
MFCD00143100
Smiles:
NC(=O)CCBr
Complexity:
54.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
-0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CC(C1)OC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CC(C1)OC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB50879
ChemicalName: 1,3-Dibromo-5-nitrobenzene
CasNumber: 6311-60-0
MolecularFormula: C6H3Br2NO2
MolecularWeight: 280.9015
MdlNumber: MFCD00092529
Smiles: Brc1cc(cc(c1)Br)[N+](=O)[O-]
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 3.3
CatalogNumber:
AB50879
ChemicalName:
1,3-Dibromo-5-nitrobenzene
CasNumber:
6311-60-0
MolecularFormula:
C6H3Br2NO2
MolecularWeight:
280.9015
MdlNumber:
MFCD00092529
Smiles:
Brc1cc(cc(c1)Br)[N+](=O)[O-]
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
3.3