AG003N1V

774-55-0 | 1-(5,6,7,8-Tetrahydronaphthalen-2-yl)ethanone

AG003N1V

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CAS Number	774-55-0
Catalog Number	AG003N1V(AGN-PC-0JL9BT)
Chemical Name	1-(5,6,7,8-Tetrahydronaphthalen-2-yl)ethanone
EC Number	212-266-7
IUPAC Name	1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
InChI	InChI=1S/C12H14O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h6-8H,2-5H2,1H3
InChI Key	VEPUKHYQNXSSKV-UHFFFAOYSA-N
MDL Number	MFCD00019710
Molecular Formula	C12H14O
Molecular Weight	174.2390
NSC Number	5179
SMILES	C1=C(C=CC=2CCCCC12)C(C)=O
UNII	6L3DBR6DE6
Synonyms	774-55-0, 1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone, 6-Acetyltetralin, 6-Acetyl tetralin, Ethanone, 1-(5,6,7,8-tetrahydro-2-naphthalenyl)-, 6-ACETYL-1,2,3,4-TETRAHYDRONAPHTHALENE, UNII-6L3DBR6DE6, 5,6,7,8-Tetrahydro-2-acetonaphthone, 6L3DBR6DE6, 1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one, 5',6',7',8'-Tetrahydro-2'-acetonaphthone, VEPUKHYQNXSSKV-UHFFFAOYSA-N, MFCD00019710, 2-acetyl-5,6,7,8-tetrahydronaphthalene, 6-Acetylteralin, 6-acetyltetraline, NSC5179, NSC 5179, EINECS 212-266-7, 1-tetralin-6-ylethanone, AI3-10031, AC1L2CVW, AC1Q1JVC, AC1Q5EMC, AC1Q1JY4, DSSTox_CID_27163, DSSTox_RID_82164, 1-(5,6,7,8-Tetrahydro-2-naphthyl)ethan-1-one, DSSTox_GSID_47163, SCHEMBL1466022, CHEMBL3188542, DTXSID0047163, 6-ACETYLTETRAHYDRONAPHTHALENE, NSC-5179, ZINC3846164, Tox21_302669, BBL035765, SBB042684, STL282256, AKOS000200330, CA-1191, MCULE-6590792221, NCGC00256770-01, AJ-45844, AN-22145, CAS-774-55-0, ST2403222, BB 0221171, CS-0063160, FT-0605784, ST50406947, W8402, A-8919, 6-Acetyl-1,2,3,4-tetrahydronaphthalene, 97%, 1-(5,6,7,8-tetrahydro-naphthalen-2-yl)-ethanone, Z57039591, C12H14O, CID69885, AR-1H0765, C12-H14-O, 1-(5,6,7,8-tetrahydro-2-naphthalenyl)ethanone, Etanona, 1-(5,6,7,8-tetrahidro-2-naftalenil)-, 81944-79-8,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.104g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.243g/mol
Monoisotopic Mass	174.104g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 3082

Certificate of Analysis

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