AG00296C

2039-76-1 | Ethanone, 1-(3-phenanthrenyl)-

AG00296C

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CAS Number	2039-76-1
Catalog Number	AG00296C(AGN-PC-0JLBWC)
Chemical Name	Ethanone, 1-(3-phenanthrenyl)-
EC Number	218-020-5
IUPAC Name	1-phenanthren-3-ylethanone
InChI	InChI=1S/C16H12O/c1-11(17)14-9-8-13-7-6-12-4-2-3-5-15(12)16(13)10-14/h2-10H,1H3
InChI Key	JKVNPRNAHRHQDD-UHFFFAOYSA-N
MDL Number	MFCD00001169
Molecular Formula	C16H12O
Molecular Weight	220.2659
NSC Number	3192
SMILES	C1=CC(=CC=2C3=CC=CC=C3C=CC12)C(C)=O
Synonyms	3-Acetylphenanthrene, 2039-76-1, 1-(phenanthren-3-yl)ethanone, Ethanone, 1-(3-phenanthrenyl)-, 1-(3-Phenanthryl)ethanone, 1-phenanthren-3-ylethanone, Methyl 3-phenanthryl ketone, Ketone, methyl 3-phenanthryl, JKVNPRNAHRHQDD-UHFFFAOYSA-N, 1-(phenanthren-3-yl)ethan-1-one, 3-Acetylphenanthrene, 97%, EINECS 218-020-5, AC1L2MTA, AC1Q5GQY, ACMC-1CLH9, DSSTox_CID_29099, DSSTox_RID_83318, DSSTox_GSID_49243, SCHEMBL50671, KSC492K8T, 1-(3-Phenanthryl)ethanone #, CHEMBL3186759, DTXSID9049243, Ethanone,1-(3-phenanthrenyl)-, CTK3J2589, JKVNPRNAHRHQDD-UHFFFAOYSA-, NSC3192, NSC-3192, ZINC1037154, Tox21_202956, 0457AB, ANW-63232, STK366110, AKOS004908916, ACM2039761, CA-1145, MCULE-1366015107, RTX-010233, TRA0028945, VZ26229, NCGC00260502-01, AC-22757, AJ-24728, AK-87890, CC-13953, CJ-04680, ZB015680, CAS-2039-76-1, AB0052749, AX8016253, DB-022171, 3-Acetylphenanthrene, technical grade, 90%, FT-0082775, FT-0614888, ST24037642, KS-00000292, C-12182, J-013276, I14-14285, InChI=1/C16H12O/c1-11(17)14-9-8-13-7-6-12-4-2-3-5-15(12)16(13)10-14/h2-10H,1H3, 3-Acetyl phenanthrene, C16H12O, KST-1B1600, CID74867, AR-1B1586, C16-H12-O, 20810-22-4,

Complexity	296
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.089g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	220.271g/mol
Monoisotopic Mass	220.089g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H332-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number