Home Other Building Blocks Naphthalene-2-carbothioamide

Naphthalene-2-carbothioamide

CAS No.:
6967-89-1
Catalog Number:
AG003SQC
Molecular Formula:
C11H9NS
Molecular Weight:
187.2609
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Product Description
Catalog Number:
AG003SQC
Chemical Name:
Naphthalene-2-carbothioamide
CAS Number:
6967-89-1
Molecular Formula:
C11H9NS
Molecular Weight:
187.2609
MDL Number:
MFCD01571356
IUPAC Name:
naphthalene-2-carbothioamide
InChI:
InChI=1S/C11H9NS/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H2,12,13)
InChI Key:
ZQGJZFKITDDUEH-UHFFFAOYSA-N
SMILES:
NC(=S)c1ccc2c(c1)cccc2
NSC Number:
20600
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.046g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.26g/mol
Monoisotopic Mass:
187.046g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties