AG003853

13362-52-2 | 1,13-Tridecanediol

AG003853

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CAS Number	13362-52-2
Catalog Number	AG003853(AGN-PC-0NFA3V)
Chemical Name	1,13-Tridecanediol
IUPAC Name	tridecane-1,13-diol
InChI	InChI=1S/C13H28O2/c14-12-10-8-6-4-2-1-3-5-7-9-11-13-15/h14-15H,1-13H2
InChI Key	HCEPYODGJFPWOI-UHFFFAOYSA-N
MDL Number	MFCD00482067
Molecular Formula	C13H28O2
Molecular Weight	216.3602
SMILES	OCCCCCCCCCCCCCO
Synonyms	1,13-Tridecanediol, Tridecane-1,13-diol, 13362-52-2, AK-33138, KSC174G3L, SCHEMBL160056, BDBM36275, CTK0H4335, KS-00000LVM, DTXSID80453878, 6104AA, MFCD00482067, ZINC14771652, AKOS015856536, CHM0005568, MCULE-9763203178, AJ-65358, CJ-14625, DS-12443, AX8052254, DB-005604, TC-061667, FT-0080549, FT-0613456, ST24050255, 362T522, I14-41558, Tridecamethylene glycol, C13H28O2, RW1361, ACN-036626, CID11063855,

Complexity	92.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.209g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	216.365g/mol
Monoisotopic Mass	216.209g/mol
Rotatable Bond Count	12
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number