AI51525
51368-55-9 | Isopropyl 2-bromo-2-methylpropanoate
Manufacturer: A2B Chem
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CatalogNumber
AI51525
ChemicalName
Isopropyl 2-bromo-2-methylpropanoate
CasNumber
51368-55-9
MolecularFormula
C7H13BrO2
MolecularWeight
209.08092
MdlNumber
MFCD00055235
Smiles
CC(OC(=O)C(Br)(C)C)C
Complexity
130
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AI51525
ChemicalName: Isopropyl 2-bromo-2-methylpropanoate
CasNumber: 51368-55-9
MolecularFormula: C7H13BrO2
MolecularWeight: 209.08092
MdlNumber: MFCD00055235
Smiles: CC(OC(=O)C(Br)(C)C)C
Complexity: 130
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AI51525
ChemicalName:
Isopropyl 2-bromo-2-methylpropanoate
CasNumber:
51368-55-9
MolecularFormula:
C7H13BrO2
MolecularWeight:
209.08092
MdlNumber:
MFCD00055235
Smiles:
CC(OC(=O)C(Br)(C)C)C
Complexity:
130
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COCCc1ccc(cc1)OCC(CNC(C)C)O
Complexity: 215
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COCCc1ccc(cc1)OCC(CNC(C)C)O
Complexity:
215
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9
CatalogNumber: AI51527
ChemicalName: Methyl(3-nitrobenzyl)sulfane
CasNumber: 51392-54-2
MolecularFormula: C8H9NO2S
MolecularWeight: 183.2276
MdlNumber: MFCD29059356
Smiles: CSCc1cccc(c1)[N+](=O)[O-]
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AI51527
ChemicalName:
Methyl(3-nitrobenzyl)sulfane
CasNumber:
51392-54-2
MolecularFormula:
C8H9NO2S
MolecularWeight:
183.2276
MdlNumber:
MFCD29059356
Smiles:
CSCc1cccc(c1)[N+](=O)[O-]
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CNC2C(C1)NC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CNC2C(C1)NC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__