AG003LK0

2589-71-1 | 4'-Hydroxyvalerophenone

AG003LK0

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CAS Number	2589-71-1
Catalog Number	AG003LK0(AGN-PC-0JLPKO)
Chemical Name	4'-Hydroxyvalerophenone
EC Number	219-978-7
IUPAC Name	1-(4-hydroxyphenyl)pentan-1-one
InChI	InChI=1S/C11H14O2/c1-2-3-4-11(13)9-5-7-10(12)8-6-9/h5-8,12H,2-4H2,1H3
InChI Key	ZKCJJGOOPOIZTE-UHFFFAOYSA-N
MDL Number	MFCD00009719
Molecular Formula	C11H14O2
Molecular Weight	178.2277
SMILES	C1=C(C=CC(=C1)O)C(CCCC)=O
UNII	RFV916NJJ6
Synonyms	4'-Hydroxyvalerophenone, 2589-71-1, 4-Valerylphenol, 1-Pentanone, 1-(4-hydroxyphenyl)-, p-Valerylphenol, 4'-Hydroxypentanophenone, p-Hydroxyvalerophenone, 1-(4-hydroxyphenyl)pentan-1-one, 4-pentanoylphenol, Valerophenone, 4'-hydroxy-, UNII-RFV916NJJ6, RFV916NJJ6, CHEMBL441370, ZKCJJGOOPOIZTE-UHFFFAOYSA-N, AK-47484, Q-100329, NSC 49321, p- Valerylphenol, EINECS 219-978-7, NSC 49186, PubChem14040, 4;-Hydroxyvalerophenone, AI3-11694, AC1L2PGY, AC1Q5ECG, ChemDiv3_014404, ACMC-20a04e, AC1Q2V6L, AC1Q2V6M, MLS000522198, SCHEMBL420677, 4'-Hydroxyvalerophenone, 98%, Jsp005107, DTXSID6062541, CTK5E9035, 1-(4-Hydroxyphenyl)-1-pentanone, HMS1513O16, HMS2469I12, KS-00000J7B, NSC49186, NSC49321, ZINC1681257, ZX-AT015092, ANW-51084, BDBM50189959, MFCD00009719, NSC-49186, NSC-49321, OR5785, SBB063295, 1-(4-Hydroxyphenyl)-1-pentanone #, AKOS001581070, ACM2589711, MCULE-1102579303, TRA0005314, IDI1_030202, NCGC00245960-01, AC-10915, AJ-29677, AN-21718, AS-12378, BR-47484, CJ-06303, CJ-27664, SMR000132606, SY009664, AX8019749, DB-046789, TC-139829, EU-0033275, FT-0618614, ST24032668, ST50405539, M-8672, 4 inverted exclamation mark -Hydroxyvalerophenone, MFCD00009719 (97+%), C-06437, SR-01000596949, I01-1168, SR-01000596949-1, Phosphine,1,1'-[(1S)-2,2',3,3'-tetrahydro-1,1'-spirobi[1H-indene]-7,7'-diyl]bis[1,1-bis(4-methylphenyl)-, 4-Hydroxyvalerophenone, C11H14O2, CID75766, 4'-Hydroxyvalerophenone, 98% 25g, AR-1G4836, C11-H14-O2, 4'-Hydroxyvalerophenone, 98% - 25g 25g, H0627, 26728-58-5, 817176-80-0,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.099g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.231g/mol
Monoisotopic Mass	178.099g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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