200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 21104-18-7
21104-18-7 | Phenol, 4-(2-buten-1-yl)-2,6-dimethyl-
CAS No: 21104-18-7 Catalog No: AG002L51 MDL No:
Product Description
Catalog Number:
AG002L51
Chemical Name:
Phenol, 4-(2-buten-1-yl)-2,6-dimethyl-
CAS Number:
21104-18-7
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
IUPAC Name:
4-but-2-enyl-2,6-dimethylphenol
InChI:
InChI=1S/C12H16O/c1-4-5-6-11-7-9(2)12(13)10(3)8-11/h4-5,7-8,13H,6H2,1-3H3
InChI Key:
CBJFZVPRUBERKE-UHFFFAOYSA-N
SMILES:
CC=CCc1cc(C)c(c(c1)C)O
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.12g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.259g/mol
Monoisotopic Mass:
176.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.