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1504-56-9 | 2-Propen-1-ol, 3-(3,4,5-trimethoxyphenyl)-
CAS No: 1504-56-9 Catalog No: AG001MKT MDL No:
Product Description
Catalog Number:
AG001MKT
Chemical Name:
2-Propen-1-ol, 3-(3,4,5-trimethoxyphenyl)-
CAS Number:
1504-56-9
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
IUPAC Name:
(E)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-ol
InChI:
InChI=1S/C12H16O4/c1-14-10-7-9(5-4-6-13)8-11(15-2)12(10)16-3/h4-5,7-8,13H,6H2,1-3H3/b5-4+
InChI Key:
HZDDMDAKGIRCPP-SNAWJCMRSA-N
SMILES:
OCC=Cc1cc(OC)c(c(c1)OC)OC
EC Number:
216-129-2
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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