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19832-37-2 | Phenol, 3-(1-ethyl-3-propyl-3-azetidinyl)-
CAS No: 19832-37-2 Catalog No: AG002BFQ MDL No:
Product Description
Catalog Number:
AG002BFQ
Chemical Name:
Phenol, 3-(1-ethyl-3-propyl-3-azetidinyl)-
CAS Number:
19832-37-2
Molecular Formula:
C14H21NO
Molecular Weight:
219.3226
IUPAC Name:
3-(1-ethyl-3-propylazetidin-3-yl)phenol
InChI:
InChI=1S/C14H21NO/c1-3-8-14(10-15(4-2)11-14)12-6-5-7-13(16)9-12/h5-7,9,16H,3-4,8,10-11H2,1-2H3
InChI Key:
VTGRLWVHXLIUOC-UHFFFAOYSA-N
SMILES:
CCCC1(CN(C1)CC)c1cccc(c1)O
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.328g/mol
Monoisotopic Mass:
219.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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