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5843-43-6

5843-43-6 | Phenyl isocyanatoformate

CAS No: 5843-43-6 Catalog No: AG003TP0 MDL No:MFCD00037080

Product Description

Catalog Number:
AG003TP0
Chemical Name:
Phenyl isocyanatoformate
CAS Number:
5843-43-6
MDL Number:
MFCD00037080
IUPAC Name:
phenyl N-(oxomethylidene)carbamate
InChI:
InChI=1S/C8H5NO3/c10-6-9-8(11)12-7-4-2-1-3-5-7/h1-5H
InChI Key:
FSZKLYCUEQGCKW-UHFFFAOYSA-N

Properties

Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.027g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.132g/mol
Monoisotopic Mass:
163.027g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Literature

Title Journal
Solid-phase synthesis of 1,7-disubstituted-1,3,5-triazepane-2,4-diones. Organic letters 20010906
Fluorescent charge-neutral analogue of xanthosine: synthesis of a 2'-deoxyribonucleoside bearing a 5-aza-7-deazaxanthine base. The Journal of organic chemistry 20010727

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