200,000+ products from a single source!
sales@angenechem.com
81995-28-0 | Benzaldehyde,2-(3-methylbutoxy)-
CAS No: 81995-28-0 Catalog No: AG004YWD MDL No:MFCD03422398
Product Description
Catalog Number:
AG004YWD
Chemical Name:
Benzaldehyde,2-(3-methylbutoxy)-
CAS Number:
81995-28-0
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD03422398
IUPAC Name:
2-(3-methylbutoxy)benzaldehyde
InChI:
InChI=1S/C12H16O2/c1-10(2)7-8-14-12-6-4-3-5-11(12)9-13/h3-6,9-10H,7-8H2,1-2H3
InChI Key:
YWRAJEBRXBINMA-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCCC(C)C
NSC Number:
69103
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.