AB19861
210228-01-6 | 1-(4-Bromo-3-methylphenyl)propan-1-one
Manufacturer: A2B Chem
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CatalogNumber
AB19861
ChemicalName
1-(4-Bromo-3-methylphenyl)propan-1-one
CasNumber
210228-01-6
MolecularFormula
C10H11BrO
MolecularWeight
227.0977
MdlNumber
MFCD18392258
Smiles
CCC(=O)c1ccc(c(c1)C)Br
Complexity
167
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
1
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AB19861
ChemicalName: 1-(4-Bromo-3-methylphenyl)propan-1-one
CasNumber: 210228-01-6
MolecularFormula: C10H11BrO
MolecularWeight: 227.0977
MdlNumber: MFCD18392258
Smiles: CCC(=O)c1ccc(c(c1)C)Br
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AB19861
ChemicalName:
1-(4-Bromo-3-methylphenyl)propan-1-one
CasNumber:
210228-01-6
MolecularFormula:
C10H11BrO
MolecularWeight:
227.0977
MdlNumber:
MFCD18392258
Smiles:
CCC(=O)c1ccc(c(c1)C)Br
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H]1NC[C@@H]([C@H]([C@@H]1O)O)O.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H]1NC[C@@H]([C@H]([C@@H]1O)O)O.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CC[C@H]1CCCN(C1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(=O)CC[C@H]1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)/C=C(C1CC1)/C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)/C=C(C1CC1)/C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__