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1225228-92-1 | 2-Oxazolidinone, 4-methyl-4-(1,2,3,4-tetrahydro-6-methoxy-2-naphthalenyl)-
CAS No: 1225228-92-1 Catalog No: AG0017D6 MDL No:MFCD23135333
Product Description
Catalog Number:
AG0017D6
Chemical Name:
2-Oxazolidinone, 4-methyl-4-(1,2,3,4-tetrahydro-6-methoxy-2-naphthalenyl)-
CAS Number:
1225228-92-1
Molecular Formula:
C15H19NO3
Molecular Weight:
261.3163
MDL Number:
MFCD23135333
IUPAC Name:
6-(2-amino-1-hydroxypropan-2-yl)-5,6,7,8-tetrahydronaphthalen-2-ol
InChI:
InChI=1S/C13H19NO2/c1-13(14,8-15)11-4-2-10-7-12(16)5-3-9(10)6-11/h3,5,7,11,15-16H,2,4,6,8,14H2,1H3
InChI Key:
ROQUHQOMQGBKNK-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)CCC(C2)C1(C)COC(=O)N1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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