ttnpb

ttnpb

CAS: 71441-28-6

Formula: C24H28O2

SMILES: C\C(=C/C1=CC=C(C=C1)C(O)=O)C1=CC=C2C(=C1)C(C)(C)CCC2(C)C

IUPAC: 4-[(1E)-2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-en-1-yl]benzoic acid

InChI: InChI=1S/C24H28O2/c1-16(14-17-6-8-18(9-7-17)22(25)26)19-10-11-20-21(15-19)24(4,5)13-12-23(20,2)3/h6-11,14-15H,12-13H2,1-5H3,(H,25,26)/b16-14+

Composition: C (82.72%), H (8.10%), O (9.18%)

Molar Mass: 348.486

Atom Count: 54

Heavy Atom Count: 26

Properties

Properties

Common Names	T3757_sigma; arotinoic acid; arotinoid acid; arotinoid ro-137410; tocris-0761; ttnpb
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	348.208930142
Formal Charge	0
FSP3	0.37
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FOIVPCKZDPCJJY-JQIJEIRASA-N
Lipinski's Rule of Five
Molar Refractivity	108.58
Topological Polar Surface Area	37.3
Polarizability	41.4
Ring Count	3
Rotatable Bond Count	3

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Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	71441-28-6		Quote Only