AG004YZR

82909-47-5 | 13-​Tetradecynoic acid

AG004YZR

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CAS Number	82909-47-5
Catalog Number	AG004YZR(AGN-PC-0LPX3U)
Chemical Name	13-​Tetradecynoic acid
IUPAC Name	tetradec-13-ynoic acid
InChI	InChI=1S/C14H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h1H,3-13H2,(H,15,16)
InChI Key	JNXXRQLAAJXERE-UHFFFAOYSA-N
MDL Number	MFCD18382104
Molecular Formula	C14H24O2
Molecular Weight	224.3392
SMILES	C(CCCCCCC#C)CCCCC(=O)O
Synonyms	13-Tetradecynoic acid, 82909-47-5, tetradec-13-ynoic acid, 13-TetradecynoicAcid, Alkynyl Myristic Acid, AC1NSNE2, 13-Tetradecyn-1-oic acid, SCHEMBL2802414, CTK3D5318, KS-00000CZQ, DTXSID50415589, JNXXRQLAAJXERE-UHFFFAOYSA-N, 1200AH, LMFA01030594, MFCD18382104, ZINC14722601, AKOS027257020, BP-23393, CS-11981, SY034595, MFCD18382104 (95%), C14H24O2, CID5312715, FA(14:2),

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.178g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	224.344g/mol
Monoisotopic Mass	224.178g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number