AA80958
15930-53-7 | 6-Bromopiperonal
Manufacturer: A2B Chem
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CatalogNumber
AA80958
ChemicalName
6-Bromopiperonal
CasNumber
15930-53-7
MolecularFormula
C8H5BrO3
MolecularWeight
229.0275
MdlNumber
MFCD00022952
Smiles
O=Cc1cc2OCOc2cc1Br
NscNumber
15639
Complexity
185
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AA80958
ChemicalName: 6-Bromopiperonal
CasNumber: 15930-53-7
MolecularFormula: C8H5BrO3
MolecularWeight: 229.0275
MdlNumber: MFCD00022952
Smiles: O=Cc1cc2OCOc2cc1Br
NscNumber: 15639
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AA80958
ChemicalName:
6-Bromopiperonal
CasNumber:
15930-53-7
MolecularFormula:
C8H5BrO3
MolecularWeight:
229.0275
MdlNumber:
MFCD00022952
Smiles:
O=Cc1cc2OCOc2cc1Br
NscNumber:
15639
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc2cnc(=O)[nH]c2cc1Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc2cnc(=O)[nH]c2cc1Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA80960
ChemicalName: Everolimus
CasNumber: 159351-69-6
MolecularFormula: C53H83NO14
MolecularWeight: 958.2244
MdlNumber: MFCD00929329
Smiles: OCCO[C@@H]1CC[C@H](C[C@H]1OC)C[C@H]([C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H](CC[C@H]2C)C[C@H](OC)C(=CC=CC=C[C@H](C[C@H](C(=O)[C@@H]([C@@H](C(=C[C@H](C(=O)C1)C)C)O)OC)C)C)C)C
NscNumber: __
Complexity: 1810
Covalently-bondedUnitCount: 1
HeavyAtomCount: 68
HydrogenBondAcceptorCount: 14
RotatableBondCount: 9
Xlogp3: 5.9
CatalogNumber:
AA80960
ChemicalName:
Everolimus
CasNumber:
159351-69-6
MolecularFormula:
C53H83NO14
MolecularWeight:
958.2244
MdlNumber:
MFCD00929329
Smiles:
OCCO[C@@H]1CC[C@H](C[C@H]1OC)C[C@H]([C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H](CC[C@H]2C)C[C@H](OC)C(=CC=CC=C[C@H](C[C@H](C(=O)[C@@H]([C@@H](C(=C[C@H](C(=O)C1)C)C)O)OC)C)C)C)C
NscNumber:
__
Complexity:
1810
Covalently-bondedUnitCount:
1
HeavyAtomCount:
68
HydrogenBondAcceptorCount:
14
RotatableBondCount:
9
Xlogp3:
5.9
CatalogNumber: AA80961
ChemicalName: (R)-2-Methoxymethoxy-1-propanol
CasNumber: 159350-97-7
MolecularFormula: C5H12O3
MolecularWeight: 120.147
MdlNumber: MFCD07367837
Smiles: C[C@@H](OCOC)CO
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AA80961
ChemicalName:
(R)-2-Methoxymethoxy-1-propanol
CasNumber:
159350-97-7
MolecularFormula:
C5H12O3
MolecularWeight:
120.147
MdlNumber:
MFCD07367837
Smiles:
C[C@@H](OCOC)CO
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__