200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 127-66-2
127-66-2 | Benzenemethanol, α-ethynyl-α-methyl-
CAS No: 127-66-2 Catalog No: AG000WIO MDL No:MFCD00004454
Product Description
Catalog Number:
AG000WIO
Chemical Name:
Benzenemethanol, α-ethynyl-α-methyl-
CAS Number:
127-66-2
Molecular Formula:
C10H10O
Molecular Weight:
146.1858
MDL Number:
MFCD00004454
IUPAC Name:
2-phenylbut-3-yn-2-ol
InChI:
InChI=1S/C10H10O/c1-3-10(2,11)9-7-5-4-6-8-9/h1,4-8,11H,2H3
InChI Key:
KSLSOBUAIFEGLT-UHFFFAOYSA-N
SMILES:
C#CC(c1ccccc1)(O)C
EC Number:
204-855-2
NSC Number:
4329
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.073g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.189g/mol
Monoisotopic Mass:
146.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.