Home Other Building Blocks 2-(THIEN-2-YL)ETHYL ISOCYANATE

2-(THIEN-2-YL)ETHYL ISOCYANATE

CAS No.:
58749-51-2
Catalog Number:
AG00E9U1
Molecular Formula:
C7H7NOS
Molecular Weight:
153.2016
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Product Description
Catalog Number:
AG00E9U1
Chemical Name:
2-(THIEN-2-YL)ETHYL ISOCYANATE
CAS Number:
58749-51-2
Molecular Formula:
C7H7NOS
Molecular Weight:
153.2016
MDL Number:
MFCD00052972
IUPAC Name:
2-(2-isocyanatoethyl)thiophene
InChI:
InChI=1S/C7H7NOS/c9-6-8-4-3-7-2-1-5-10-7/h1-2,5H,3-4H2
InChI Key:
KAJZMNLREUEZSH-UHFFFAOYSA-N
SMILES:
O=C=NCCc1cccs1
Properties
Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.025g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.199g/mol
Monoisotopic Mass:
153.025g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties