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7465-63-6

7465-63-6 | Oxazole,4,5-dihydro-2-(4-nitrophenyl)-

CAS No: 7465-63-6 Catalog No: AG005ADZ MDL No:MFCD06149933

Product Description

Catalog Number:
AG005ADZ
Chemical Name:
Oxazole,4,5-dihydro-2-(4-nitrophenyl)-
CAS Number:
7465-63-6
Molecular Formula:
C9H8N2O3
Molecular Weight:
192.1714
MDL Number:
MFCD06149933
IUPAC Name:
2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C9H8N2O3/c12-11(13)8-3-1-7(2-4-8)9-10-5-6-14-9/h1-4H,5-6H2
InChI Key:
MPQNFLWWBYWJGE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C1=NCCO1
NSC Number:
54393

Properties

Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.053g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.174g/mol
Monoisotopic Mass:
192.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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