1-Naphthaleneacetic acid, a-methoxy-a-methyl-, (aS)-


Chemical Name: 1-Naphthaleneacetic acid, a-methoxy-a-methyl-, (aS)-
CAS Number: 102691-93-0
Product Number: AG00084K(AGN-PC-0ORS9H)
Synonyms:
MDL No: MFCD03093634
Molecular Formula: C14H14O3
Molecular Weight: 230.2592

Identification/Properties


Computed Properties
Molecular Weight:
230.263g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
230.094g/mol
Monoisotopic Mass:
230.094g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
289
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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