AG002ZW2

30364-38-6 | Naphthalene, 1,2-dihydro-1,1,6-trimethyl-

AG002ZW2

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CAS Number	30364-38-6
Catalog Number	AG002ZW2(AGN-PC-0JLNN2)
Chemical Name	Naphthalene, 1,2-dihydro-1,1,6-trimethyl-
EC Number	250-150-8
IUPAC Name	1,1,6-trimethyl-2H-naphthalene
InChI	InChI=1S/C13H16/c1-10-6-7-12-11(9-10)5-4-8-13(12,2)3/h4-7,9H,8H2,1-3H3
InChI Key	RTUMCNDCAVLXEP-UHFFFAOYSA-N
MDL Number	MFCD07438046
Molecular Formula	C13H16
Molecular Weight	172.2661
SMILES	CC1=CC2=C(C(C)(C)CC=C2)C=C1
UNII	01HD1KNX99
Synonyms	1,1,6-trimethyl-1,2-dihydronaphthalene, TDN compound, 1,1,6-Trimethyl-1,2-dihydronaphthalene, 30364-38-6, 1,2-Dihydro-1,1,6-trimethylnaphthalene, Dehydro-ar-ionene, Naphthalene, 1,2-dihydro-1,1,6-trimethyl-, UNII-01HD1KNX99, 1,1,6-trimethyl-2H-naphthalene, 01HD1KNX99, 1,1,6-Trimethyl-1,2-dihydro-naphthalene, EINECS 250-150-8, 3,4-Dehydroionene, AC1Q1IHQ, AC1L3T71, CHEBI:89773, CTK1C2409, DTXSID30184443, RTUMCNDCAVLXEP-UHFFFAOYSA-N, MFCD07438046, ZINC71254667, AKOS006286101, 1,1,6-trimethyl-1,2-dihydronaphtalene, Napthalene,1,2,diydro-1,1,6-trimethyl, AK385861, DB-081441, FT-0737101, KST-1B2989, AR-1B4104, CID121677, C13-H16, 1,5,8-Trimethyl-1,2-dihydronaphthalene, 1,2-DIHYDRO-1,5,8-TRIMETHYLNAPHTHALENE, 3148-73-0, TDN,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.125g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.271g/mol
Monoisotopic Mass	172.125g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^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	P261-P305+P351+P338
UN Code

Certificate of Analysis

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