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208934-93-4 | Benzoxazole, 3a,4,5,7a-tetrahydro-2-(1-methylethyl)-, (3aR,7aS)-rel- (9CI)
CAS No: 208934-93-4 Catalog No: AG00BLJH MDL No:
Product Description
Catalog Number:
AG00BLJH
Chemical Name:
Benzoxazole, 3a,4,5,7a-tetrahydro-2-(1-methylethyl)-, (3aR,7aS)-rel- (9CI)
CAS Number:
208934-93-4
IUPAC Name:
(3aR,7aS)-2-propan-2-yl-3a,4,5,7a-tetrahydro-1,3-benzoxazole
InChI:
InChI=1S/C10H15NO/c1-7(2)10-11-8-5-3-4-6-9(8)12-10/h4,6-9H,3,5H2,1-2H3/t8-,9+/m1/s1
InChI Key:
HZVBNTRJHAMQAL-BDAKNGLRSA-N
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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