AG003DKG

575-41-7 | 1,3-Dimethylnaphthalene

AG003DKG

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CAS Number	575-41-7
Catalog Number	AG003DKG(AGN-PC-0JK9ZC)
Chemical Name	1,3-Dimethylnaphthalene
EC Number	209-384-6
IUPAC Name	1,3-dimethylnaphthalene
InChI	InChI=1S/C12H12/c1-9-7-10(2)12-6-4-3-5-11(12)8-9/h3-8H,1-2H3
InChI Key	QHJMFSMPSZREIF-UHFFFAOYSA-N
MDL Number	MFCD00004036
Molecular Formula	C12H12
Molecular Weight	156.2237
NSC Number	66991
SMILES	CC1=CC(C)=C2C=CC=CC2=C1
UNII	3RY1AV3CER
Synonyms	1,3-DIMETHYLNAPHTHALENE, 575-41-7, Naphthalene, 1,3-dimethyl-, 1,3-DMN, 1,3-dimethyl-naphthalene, EINECS 209-384-6, UNII-3RY1AV3CER, NSC 66991, 3RY1AV3CER, BRN 2039378, CHEMBL370524, 1,3-Dimethylnaphthalene, 96%, CHEBI:48614, MFCD00004036, NSC66991, ACMC-1AJSV, 1,3-Dimethyl naphthalene, AC1L1X4A, Naphthalene,1,3-dimethyl-, 4-05-00-01708 (Beilstein Handbook Reference), DTXSID9060360, QHJMFSMPSZREIF-UHFFFAOYSA-N, ZINC1694147, ANW-32742, BDBM50159274, NSC-66991, STL509279, AKOS015913366, FCH1117848, VZ20594, 111495-85-3, CC-03172, CJ-28398, LS-94558, BB0265999, TR-020082, D0830, FT-0606698, ST45021940, C-03573, I14-46765, InChI=1/C12H12/c1-9-7-10(2)12-6-4-3-5-11(12)8-9/h3-8H,1-2H, Naphthalene,3-dimethyl-, CID11327, C12-H12, 1,3-Dimethylnaphthalene (<lt/> 100 microg/ml) in acetonitrile,

Complexity	150
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	156.094g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	156.228g/mol
Monoisotopic Mass	156.094g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H410
Precuationary statements	P273-P501
Siginal words

Certificate of Analysis

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