200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 116292-41-2
116292-41-2 | 1-Benzoxepin-5-ol, 5-ethenyl-2,3,4,5-tetrahydro-
CAS No: 116292-41-2 Catalog No: AG000C4P MDL No:
Product Description
Catalog Number:
AG000C4P
Chemical Name:
1-Benzoxepin-5-ol, 5-ethenyl-2,3,4,5-tetrahydro-
CAS Number:
116292-41-2
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
IUPAC Name:
5-ethenyl-3,4-dihydro-2H-1-benzoxepin-5-ol
InChI:
InChI=1S/C12H14O2/c1-2-12(13)8-5-9-14-11-7-4-3-6-10(11)12/h2-4,6-7,13H,1,5,8-9H2
InChI Key:
SYIIECYABPPKOD-UHFFFAOYSA-N
SMILES:
C=CC1(O)CCCOc2c1cccc2
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.