AG00DXIQ

Name: 3H-2-Oxa-1H-Phenalene-1-One
Brand: Angene Chemical
SKU: AG00DXIQ

518-86-5 | 3H-2-Oxa-1H-Phenalene-1-One

AG00DXIQ

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CAS Number	518-86-5
Catalog Number	AG00DXIQ(AGN-PC-0JNCHO)
Chemical Name	3H-2-Oxa-1H-Phenalene-1-One
IUPAC Name	3-oxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaen-2-one
InChI	InChI=1S/C12H8O2/c13-12-10-6-2-4-8-3-1-5-9(7-14-12)11(8)10/h1-6H,7H2
InChI Key	UKOVZLWSUZKTRL-UHFFFAOYSA-N
MDL Number	MFCD00138509
Molecular Formula	C12H8O2
Molecular Weight	184.1907
NSC Number	11845
SMILES	C1(OCC2=C3C(C=CC=C13)=CC=C2)=O
Synonyms	Naphthalide, peri-Naphthalide, Naphthalid, 1H,3H-Benzo[de]isochromen-1-one, 518-86-5, 1H,3H-Naphtho[1,8-cd]pyran-1-one, Benzo[de]isochromen-1(3H)-one, 1,8-Naphthalide, CHEMBL1479195, UKOVZLWSUZKTRL-UHFFFAOYSA-N, Perinaphthalide, Peri- Naphthalide, NSC11845, Peri - NAPHTHALIDE, AC1L5CUN, AC1Q6HOX, 1H,8-cd]pyran-1-one, MLS000087667, AC1Q6O72, SCHEMBL15242520, DTXSID80279237, HMS1649I07, HMS2442A22, ZINC247810, 1-Naphthoic acid, .delta.-lactone, KS-00001WA8, BDBM50426848, MFCD00138509, NSC-11845, 1H,3H-Benzo[de]isochromen-1-one #, AKOS002384460, MCULE-4197773563, SMR000023888, 4C-112, SR-01000400051, SR-01000400051-1, 1-Naphthoic acid, 8-(hydroxymethyl)-, .delta.-lactone, 1-Naphthalenecarboxylic acid, 8-(hydroxymethyl)-, .delta.-lactone, 3-oxatricyclo[7.3.1.0?,??]trideca-1(12),5(13),6,8,10-pentaen-2-one, 3-oxatricyclo[7.3.1.0^{5,13}]trideca-1(12),5(13),6,8,10-pentaen-2-one, 3-oxatricyclo[7.3.1.0^{5,13}]trideca-1(12),5,7,9(13),10-pentaen-2-one, 9CG, 3H-2-Oxa-1H-phenalene-1-one, AR-1C3168, CID223824, 1-Naphthalenecarboxylic acid, .delta.-lactone, 5465-68-9,

Complexity	249
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.052g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	184.194g/mol
Monoisotopic Mass	184.052g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited