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37116-80-6 | 3-[2-(4-Hydroxyphenyl)ethyl]phenol
CAS No: 37116-80-6 Catalog No: AG003ALG MDL No:MFCD24713452
Product Description
Catalog Number:
AG003ALG
Chemical Name:
3-[2-(4-Hydroxyphenyl)ethyl]phenol
CAS Number:
37116-80-6
Molecular Formula:
C14H14O2
Molecular Weight:
214.2598
MDL Number:
MFCD24713452
IUPAC Name:
3-[2-(4-hydroxyphenyl)ethyl]phenol
InChI:
InChI=1S/C14H14O2/c15-13-8-6-11(7-9-13)4-5-12-2-1-3-14(16)10-12/h1-3,6-10,15-16H,4-5H2
InChI Key:
ILEYXPCRQKRNIJ-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)CCc1cccc(c1)O
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.099g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.264g/mol
Monoisotopic Mass:
214.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| Macrocylic bisbibenzyl natural products and their chemical synthesis. | Natural product reports 20120201 |
| [Chemical constituents of fresh celery]. | Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica 20090601 |
| Activity of a hydroxybibenzyl bryophyte constituent against Leishmania spp. and Trypanosoma cruzi: in silico, in vitro and in vivo activity studies. | European journal of medicinal chemistry 20080901 |
| Terpenoids and bisbibenzyls from Chinese liverworts Conocephalum conicum and Dumortiera hirsuta. | Journal of Asian natural products research 20060101 |
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