Home Other Building Blocks 1-Naphthyl isothiocyanate

1-Naphthyl isothiocyanate

CAS No.:
551-06-4
Catalog Number:
AG003EJN
Molecular Formula:
C11H7NS
Molecular Weight:
185.2450
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$69
- +
5g
97%
In Stock USA
United States
$175
- +
25g
97%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG003EJN
Chemical Name:
1-Naphthyl isothiocyanate
CAS Number:
551-06-4
Molecular Formula:
C11H7NS
Molecular Weight:
185.2450
MDL Number:
MFCD00003882
IUPAC Name:
1-isothiocyanatonaphthalene
InChI:
InChI=1S/C11H7NS/c13-8-12-11-7-3-5-9-4-1-2-6-10(9)11/h1-7H
InChI Key:
JBDOSUUXMYMWQH-UHFFFAOYSA-N
SMILES:
S=C=Nc1cccc2c1cccc2
UNII:
HG44814A3V
NSC Number:
89741
UN Number:
2811
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.03g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.244g/mol
Monoisotopic Mass:
185.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Literature
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Properties