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89205-38-9 | Tetradecanoic acid, 2-[4-[(2-propenylsulfonyl)amino]phenoxy]-
CAS No: 89205-38-9 Catalog No: AG00464T MDL No:
Product Description
Catalog Number:
AG00464T
Chemical Name:
Tetradecanoic acid, 2-[4-[(2-propenylsulfonyl)amino]phenoxy]-
CAS Number:
89205-38-9
Molecular Formula:
C23H37NO5S
Molecular Weight:
439.6086
IUPAC Name:
2-[4-(prop-2-enylsulfonylamino)phenoxy]tetradecanoic acid
InChI:
InChI=1S/C23H37NO5S/c1-3-5-6-7-8-9-10-11-12-13-14-22(23(25)26)29-21-17-15-20(16-18-21)24-30(27,28)19-4-2/h4,15-18,22,24H,2-3,5-14,19H2,1H3,(H,25,26)
InChI Key:
RVWMPRDMSYIMON-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCC(C(=O)O)Oc1ccc(cc1)NS(=O)(=O)CC=C
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
439.239g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
439.611g/mol
Monoisotopic Mass:
439.239g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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