AB65781
76347-62-1 | 4-(4-Bromophenyl)-2-methylbut-3-yn-2-ol
Manufacturer: A2B Chem
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CatalogNumber
AB65781
ChemicalName
4-(4-Bromophenyl)-2-methylbut-3-yn-2-ol
CasNumber
76347-62-1
MolecularFormula
C11H11BrO
MolecularWeight
239.1084
MdlNumber
MFCD00168840
Smiles
CC(C#Cc1ccc(cc1)Br)(O)C
Complexity
225
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AB65781
ChemicalName: 4-(4-Bromophenyl)-2-methylbut-3-yn-2-ol
CasNumber: 76347-62-1
MolecularFormula: C11H11BrO
MolecularWeight: 239.1084
MdlNumber: MFCD00168840
Smiles: CC(C#Cc1ccc(cc1)Br)(O)C
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AB65781
ChemicalName:
4-(4-Bromophenyl)-2-methylbut-3-yn-2-ol
CasNumber:
76347-62-1
MolecularFormula:
C11H11BrO
MolecularWeight:
239.1084
MdlNumber:
MFCD00168840
Smiles:
CC(C#Cc1ccc(cc1)Br)(O)C
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AB65782
ChemicalName: 4-(4-Bromophenyl)-2-thiazoleacetonitrile
CasNumber: 94833-31-5
MolecularFormula: C11H7BrN2S
MolecularWeight: 279.1557
MdlNumber: MFCD00551793
Smiles: N#CCc1scc(n1)c1ccc(cc1)Br
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AB65782
ChemicalName:
4-(4-Bromophenyl)-2-thiazoleacetonitrile
CasNumber:
94833-31-5
MolecularFormula:
C11H7BrN2S
MolecularWeight:
279.1557
MdlNumber:
MFCD00551793
Smiles:
N#CCc1scc(n1)c1ccc(cc1)Br
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3
CatalogNumber: AB65783
ChemicalName: 4-(4'-Bromophenyl)-4-hydroxypiperidine
CasNumber: 57988-58-6
MolecularFormula: C11H14BrNO
MolecularWeight: 256.139
MdlNumber: MFCD00067034
Smiles: OC1(CCNCC1)c1ccc(cc1)Br
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AB65783
ChemicalName:
4-(4'-Bromophenyl)-4-hydroxypiperidine
CasNumber:
57988-58-6
MolecularFormula:
C11H14BrNO
MolecularWeight:
256.139
MdlNumber:
MFCD00067034
Smiles:
OC1(CCNCC1)c1ccc(cc1)Br
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AB65784
ChemicalName: 4-(4-Bromophenyl)butanoic acid
CasNumber: 35656-89-4
MolecularFormula: C10H11BrO2
MolecularWeight: 243.0971
MdlNumber: MFCD00463170
Smiles: OC(=O)CCCc1ccc(cc1)Br
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3
CatalogNumber:
AB65784
ChemicalName:
4-(4-Bromophenyl)butanoic acid
CasNumber:
35656-89-4
MolecularFormula:
C10H11BrO2
MolecularWeight:
243.0971
MdlNumber:
MFCD00463170
Smiles:
OC(=O)CCCc1ccc(cc1)Br
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3