Home Other Building Blocks 1-cyclopropyl-4-isocyanatobenzene

1-cyclopropyl-4-isocyanatobenzene

CAS No.:
1629128-24-0
Catalog Number:
AG01DVSE
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
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Product Description
Catalog Number:
AG01DVSE
Chemical Name:
1-cyclopropyl-4-isocyanatobenzene
CAS Number:
1629128-24-0
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD31649293
IUPAC Name:
1-cyclopropyl-4-isocyanatobenzene
InChI:
InChI=1S/C10H9NO/c12-7-11-10-5-3-9(4-6-10)8-1-2-8/h3-6,8H,1-2H2
InChI Key:
VWOOCUCYLRCKDX-UHFFFAOYSA-N
SMILES:
O=C=Nc1ccc(cc1)C1CC1
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
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:
3.6  
Properties