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81286-82-0 | (3R,7AS)-3-(TERT-BUTYL)TETRAHYDROPYRROLO[1,2-C]OXAZOL-1(3H)-ONE
CAS No: 81286-82-0 Catalog No: AG01DKWT MDL No:
Product Description
Catalog Number:
AG01DKWT
Chemical Name:
(3R,7AS)-3-(TERT-BUTYL)TETRAHYDROPYRROLO[1,2-C]OXAZOL-1(3H)-ONE
CAS Number:
81286-82-0
IUPAC Name:
(3R,7aS)-3-tert-butyl-5,6,7,7a-tetrahydro-3H-pyrrolo[1,2-c][1,3]oxazol-1-one
InChI:
InChI=1S/C10H17NO2/c1-10(2,3)9-11-6-4-5-7(11)8(12)13-9/h7,9H,4-6H2,1-3H3/t7-,9+/m0/s1
InChI Key:
FUMQATWTNPOQKF-IONNQARKSA-N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
183.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.251g/mol
Monoisotopic Mass:
183.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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