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2059999-56-1 | 6,7-dihydro-4H-spiro[1,2-benzoxazole-5,2'-[1,3]dioxolane]-3-ol
CAS No: 2059999-56-1 Catalog No: AG01BY7T MDL No:MFCD30488676
Product Description
Catalog Number:
AG01BY7T
Chemical Name:
6,7-dihydro-4H-spiro[1,2-benzoxazole-5,2'-[1,3]dioxolane]-3-ol
CAS Number:
2059999-56-1
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
MDL Number:
MFCD30488676
IUPAC Name:
spiro[1,3-dioxolane-2,5'-6,7-dihydro-4H-1,2-benzoxazole]-3'-one
InChI:
InChI=1S/C9H11NO4/c11-8-6-5-9(12-3-4-13-9)2-1-7(6)14-10-8/h1-5H2,(H,10,11)
InChI Key:
YABDLCPLCHXXIK-UHFFFAOYSA-N
SMILES:
Oc1noc2c1CC1(OCCO1)CC2
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.19g/mol
Monoisotopic Mass:
197.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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