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63009-74-5

63009-74-5 | trans-2-Phenylcyclopropyl isocyanate

CAS No: 63009-74-5 Catalog No: AG003UWS MDL No:

Product Description

Catalog Number:
AG003UWS
Chemical Name:
trans-2-Phenylcyclopropyl isocyanate
CAS Number:
63009-74-5
IUPAC Name:
[(1S,2R)-2-isocyanatocyclopropyl]benzene
InChI:
InChI=1S/C10H9NO/c12-7-11-10-6-9(10)8-4-2-1-3-5-8/h1-5,9-10H,6H2/t9-,10+/m0/s1
InChI Key:
DYUXVJAFBUZREW-VHSXEESVSA-N
NSC Number:
80668

Properties

Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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