Home Other Building Blocks N-Hydroxy-3,6-epoxy-1,2,3,6-tetrahydrophthalimide

N-Hydroxy-3,6-epoxy-1,2,3,6-tetrahydrophthalimide

CAS No.:
5596-17-8
Catalog Number:
AG0033C8
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
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Product Description
Catalog Number:
AG0033C8
Chemical Name:
N-Hydroxy-3,6-epoxy-1,2,3,6-tetrahydrophthalimide
CAS Number:
5596-17-8
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
MDL Number:
MFCD00180244
IUPAC Name:
2-hydroxy-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
InChI:
InChI=1S/C8H7NO4/c10-7-5-3-1-2-4(13-3)6(5)8(11)9(7)12/h1-6,12H
InChI Key:
PPVGNPSAUJFBJY-UHFFFAOYSA-N
SMILES:
ON1C(=O)C2C(C1=O)C1OC2C=C1
NSC Number:
245380
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.038g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.147g/mol
Monoisotopic Mass:
181.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties