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101693-40-7 | Oxirane, 2-[(4-methylphenoxy)methyl]-, (2S)-
CAS No: 101693-40-7 Catalog No: AG00058D MDL No:MFCD25372770
Product Description
Catalog Number:
AG00058D
Chemical Name:
Oxirane, 2-[(4-methylphenoxy)methyl]-, (2S)-
CAS Number:
101693-40-7
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD25372770
IUPAC Name:
(2S)-2-[(4-methylphenoxy)methyl]oxirane
InChI:
InChI=1S/C10H12O2/c1-8-2-4-9(5-3-8)11-6-10-7-12-10/h2-5,10H,6-7H2,1H3/t10-/m1/s1
InChI Key:
CUFXMPWHOWYNSO-SNVBAGLBSA-N
SMILES:
Cc1ccc(cc1)OC[C@H]1OC1
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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