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(S)-(+)-2-HEXYL ISOCYANATE

CAS No.:
745783-78-2
Catalog Number:
AG003CGP
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003CGP
Chemical Name:
(S)-(+)-2-HEXYL ISOCYANATE
CAS Number:
745783-78-2
MDL Number:
MFCD05664080
IUPAC Name:
(2S)-2-isocyanatohexane
InChI:
InChI=1S/C7H13NO/c1-3-4-5-7(2)8-6-9/h7H,3-5H2,1-2H3/t7-/m0/s1
InChI Key:
JNWLFMYCGXLVJQ-ZETCQYMHSA-N
Properties
Complexity:
106  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties