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1366386-61-9 | 2-[4-(Hydroxymethyl)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenol
CAS No: 1366386-61-9 Catalog No: AG00HUOC MDL No:MFCD22385533
Product Description
Catalog Number:
AG00HUOC
Chemical Name:
2-[4-(Hydroxymethyl)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenol
CAS Number:
1366386-61-9
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
MDL Number:
MFCD22385533
IUPAC Name:
2-[4-(hydroxymethyl)-4-methyl-5H-1,3-oxazol-2-yl]phenol
InChI:
InChI=1S/C11H13NO3/c1-11(6-13)7-15-10(12-11)8-4-2-3-5-9(8)14/h2-5,13-14H,6-7H2,1H3
InChI Key:
CSNLKSQALXYCGY-UHFFFAOYSA-N
SMILES:
OCC1(C)COC(=N1)c1ccccc1O
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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