sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks (S)-(+)-1-(1-NAPHTHYL)ETHYL ISOCYANATE

(S)-(+)-1-(1-NAPHTHYL)ETHYL ISOCYANATE

CAS No.:
73671-79-1
Catalog Number:
AG003CFE
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG003CFE
Chemical Name:
(S)-(+)-1-(1-NAPHTHYL)ETHYL ISOCYANATE
CAS Number:
73671-79-1
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
MDL Number:
MFCD00064181
IUPAC Name:
1-[(1S)-1-isocyanatoethyl]naphthalene
InChI:
InChI=1S/C13H11NO/c1-10(14-9-15)12-8-4-6-11-5-2-3-7-13(11)12/h2-8,10H,1H3/t10-/m0/s1
InChI Key:
GONOHGQPZFXJOJ-JTQLQIEISA-N
SMILES:
O=C=N[C@H](c1cccc2c1cccc2)C
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Literature
Title Journal
Original normal-phase high-performance liquid chromatographic separation of monoacylglycerol classes from extra virgin olive oil triacylglycerols for their stereospecific analysis. Journal of AOAC International 20070101
Properties