CAS 1576-67-6 | Phenanthrene, 3,6-dimethyl- | CAS Number 1576-67-6

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1576-67-6 | Phenanthrene, 3,6-dimethyl-

CAS No: 1576-67-6 Catalog No: AG001PJZ MDL No:MFCD00001170

Product Description

Catalog Number:

AG001PJZ

Chemical Name:

Phenanthrene, 3,6-dimethyl-

CAS Number:

1576-67-6

Molecular Formula:

C16H14

Molecular Weight:

206.2824

MDL Number:

MFCD00001170

IUPAC Name:

3,6-dimethylphenanthrene

InChI:

InChI=1S/C16H14/c1-11-3-5-13-7-8-14-6-4-12(2)10-16(14)15(13)9-11/h3-10H,1-2H3

InChI Key:

OMIBPZBOAJFEJS-UHFFFAOYSA-N

SMILES:

Cc1ccc2c(c1)c1cc(C)ccc1cc2

EC Number:

216-409-4

UNII:

25Y8J5A29M

NSC Number:

60070

Properties

Complexity:

218

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

206.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

206.288g/mol

Monoisotopic Mass:

206.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.5

Literature

Title	Journal
Chemical profile of the organic residue from ancient amphora found in the Adriatic Sea determined by direct GC and GC-MS analysis.	Molecules (Basel, Switzerland) 20110914
Navajo coal combustion and respiratory health near Shiprock, New Mexico.	Journal of environmental and public health 20100101
Isolation and taxonomic and catabolic characterization of a 3,6-dimethylphenanthrene-utilizing strain of Sphingomonas sp.	Canadian journal of microbiology 20030201