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1135-63-3 | 1-Aziridineethanol, β-ethyl-β-methyl-α-phenyl-
CAS No: 1135-63-3 Catalog No: AG0008S4 MDL No:
Product Description
Catalog Number:
AG0008S4
Chemical Name:
1-Aziridineethanol, β-ethyl-β-methyl-α-phenyl-
CAS Number:
1135-63-3
Molecular Formula:
C13H19NO
Molecular Weight:
205.2961
IUPAC Name:
2-(aziridin-1-yl)-2-methyl-1-phenylbutan-1-ol
InChI:
InChI=1S/C13H19NO/c1-3-13(2,14-9-10-14)12(15)11-7-5-4-6-8-11/h4-8,12,15H,3,9-10H2,1-2H3
InChI Key:
XLWZBTOYPSSQQV-UHFFFAOYSA-N
SMILES:
CCC(C(c1ccccc1)O)(N1CC1)C
NSC Number:
407116
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.147g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.301g/mol
Monoisotopic Mass:
205.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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