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Home Other Building Blocks 2-Methyl-4-(o-tolyl)but-3-yn-2-ol

2-Methyl-4-(o-tolyl)but-3-yn-2-ol

CAS No.:
40888-14-0
Catalog Number:
AG003HNB
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG003HNB
Chemical Name:
2-Methyl-4-(o-tolyl)but-3-yn-2-ol
CAS Number:
40888-14-0
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
MDL Number:
MFCD13195741
IUPAC Name:
2-methyl-4-(2-methylphenyl)but-3-yn-2-ol
InChI:
InChI=1S/C12H14O/c1-10-6-4-5-7-11(10)8-9-12(2,3)13/h4-7,13H,1-3H3
InChI Key:
ZVFBFIMYVLBIHJ-UHFFFAOYSA-N
SMILES:
Cc1ccccc1C#CC(O)(C)C
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.104g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.243g/mol
Monoisotopic Mass:
174.104g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties