AG00034Z

1009-11-6 | 1-Butanone, 1-(4-hydroxyphenyl)-

AG00034Z

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CAS Number	1009-11-6
Catalog Number	AG00034Z(AGN-PC-0JL6Z9)
Chemical Name	1-Butanone, 1-(4-hydroxyphenyl)-
EC Number	213-766-8
IUPAC Name	1-(4-hydroxyphenyl)butan-1-one
InChI	InChI=1S/C10H12O2/c1-2-3-10(12)8-4-6-9(11)7-5-8/h4-7,11H,2-3H2,1H3
InChI Key	GFBLPULLSAPXDC-UHFFFAOYSA-N
MDL Number	MFCD00020173
Molecular Formula	C10H12O2
Molecular Weight	164.2011
NSC Number	17548
SMILES	C(=O)(CCC)c1ccc(cc1)O
Synonyms	4'-Hydroxybutyrophenone, 1009-11-6, 1-(4-Hydroxyphenyl)butan-1-one, 1-Butanone, 1-(4-hydroxyphenyl)-, p-Butyrylphenol, p-Hydroxybutyrophenone, 1-(4-Hydroxyphenyl)-1-butanone, 4-Butyrylphenol, Butyrophenone, 4'-hydroxy-, p-Hydroxyphenyl propyl ketone, NSC 17548, CHEMBL214150, GFBLPULLSAPXDC-UHFFFAOYSA-N, 4 -Hydroxybutyrophenone, 1-[4-Hydroxyphenyl]-1-butanone, 4-Butanoylphenol, NSC17548, EINECS 213-766-8, PubChem21420, ACMC-1BYOK, ChemDiv2_002250, AC1L24LW, AC1Q2UF0, AC1Q2UF1, 4-Hydroxyphenyl Propyl Ketone, SCHEMBL151228, Jsp000170, DTXSID5061405, CTK3J9354, ZINC78215, HMS1375G06, 1-Butanone,1-(4-hydroxyphenyl)-, KS-00000C4J, ZERO/000922, Butyrophenone, 4'-hydroxy- (8CI), ANW-14392, BDBM50189960, MFCD00020173, NSC-17548, SBB001584, STK735180, AKOS000369841, MCULE-9021396113, PS-4201, NCGC00338646-01, AJ-10444, AK114518, AN-48294, SC-22414, ST088650, SY018273, ZB002789, ST2415018, TC-103137, FT-0633239, K-0200, 4 inverted exclamation mark -Hydroxybutyrophenone, AB01314399-03, MFCD00020173 (97+%), SR-01000524003, I01-1169, SR-01000524003-1, W-108932, F0907-4237, 4-Hydroxybutyrophenone, 4-Hydroxy-n-butyrophenone, C10H12O2, CID66092, C10-H12-O2, H0903,

Complexity	146
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.084g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.204g/mol
Monoisotopic Mass	164.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number