AA53080
1215077-69-2 | 1-Bromo-3-(butane-1-sulfinyl)benzene
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AA53080
ChemicalName
1-Bromo-3-(butane-1-sulfinyl)benzene
CasNumber
1215077-69-2
MolecularFormula
C10H13BrOS
MolecularWeight
261.1786
MdlNumber
MFCD20441854
Smiles
CCCCS(=O)c1cccc(c1)Br
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
2.9
Related Products
Compare Similar Items
Show Difference
CatalogNumber: AA53080
ChemicalName: 1-Bromo-3-(butane-1-sulfinyl)benzene
CasNumber: 1215077-69-2
MolecularFormula: C10H13BrOS
MolecularWeight: 261.1786
MdlNumber: MFCD20441854
Smiles: CCCCS(=O)c1cccc(c1)Br
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.9
CatalogNumber:
AA53080
ChemicalName:
1-Bromo-3-(butane-1-sulfinyl)benzene
CasNumber:
1215077-69-2
MolecularFormula:
C10H13BrOS
MolecularWeight:
261.1786
MdlNumber:
MFCD20441854
Smiles:
CCCCS(=O)c1cccc(c1)Br
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.9
CatalogNumber: AA53081
ChemicalName: Methyl 3-fluoro-4-(methylsulfonyl)benzoate
CasNumber: 1215074-49-9
MolecularFormula: C9H9FO4S
MolecularWeight: 232.2288
MdlNumber: MFCD15143295
Smiles: COC(=O)c1ccc(c(c1)F)S(=O)(=O)C
Complexity: 333
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 1.1
CatalogNumber:
AA53081
ChemicalName:
Methyl 3-fluoro-4-(methylsulfonyl)benzoate
CasNumber:
1215074-49-9
MolecularFormula:
C9H9FO4S
MolecularWeight:
232.2288
MdlNumber:
MFCD15143295
Smiles:
COC(=O)c1ccc(c(c1)F)S(=O)(=O)C
Complexity:
333
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(N)ccc1C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(N)ccc1C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AA53083
ChemicalName: 8-Bromo-2,3,4,5-tetrahydrobenzo[f][1,4]oxazepine
CasNumber: 1215074-47-7
MolecularFormula: C9H10BrNO
MolecularWeight: 228.0858
MdlNumber: MFCD13186756
Smiles: Brc1ccc2c(c1)OCCNC2
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.7
CatalogNumber:
AA53083
ChemicalName:
8-Bromo-2,3,4,5-tetrahydrobenzo[f][1,4]oxazepine
CasNumber:
1215074-47-7
MolecularFormula:
C9H10BrNO
MolecularWeight:
228.0858
MdlNumber:
MFCD13186756
Smiles:
Brc1ccc2c(c1)OCCNC2
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.7