AG000POM

1198-84-1 | Benzeneacetic acid, α,4-dihydroxy-

AG000POM

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CAS Number	1198-84-1
Catalog Number	AG000POM(AGN-PC-0PDX8P)
Chemical Name	Benzeneacetic acid, α,4-dihydroxy-
IUPAC Name	2-hydroxy-2-(4-hydroxyphenyl)acetic acid
InChI	InChI=1S/C8H8O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)
InChI Key	YHXHKYRQLYQUIH-UHFFFAOYSA-N
MDL Number	MFCD00004234
Molecular Formula	C8H8O4
Molecular Weight	168.1467
SMILES	O=C(O)C(O)C1=CC=C(O)C=C1
Synonyms	4-hydroxymandelic acid, 4-hydroxymandelic acid, (D)-isomer, para-hydroxymandelic acid, pisolithin B, 2-hydroxy-2-(4-hydroxyphenyl)acetic acid, 1198-84-1, 4-Hydroxyphenylglycolic acid, 4-Hydroxymandelic acid, p-Hydroxymandelic acid, DL-4-Hydroxymandelic acid, 4-Hydroxymandelate, Hydroxy(4-hydroxyphenyl)acetic acid, Dl-4-hydroxymandelicacid, CHEBI:16388, YHXHKYRQLYQUIH-UHFFFAOYSA-N, alpha,4-Dihydroxybenzeneacetic acid, 7198-10-9, 4-Hydroxymandelic Acid Hydrate, hydroxy(4-hydroxyphenyl)acetate, D-p-hydroxymandelate, D-4-hydroxymandelate, Mandelic acid, p-hydroxy-, p-Hydroxymandelate, p-hydroxy-Mandelate, EINECS 214-839-7, DL-p-Hydroxymandelate, DL-4-Hydroxymandelate, (S)-2-Hydroxy-2-(4-hydroxyphenyl)acetic acid, parahydroxymandelic acid, p-Hydroxyphenylglycolate, delta-p-hydroxymandelate, p-hydroxy-Mandelic acid, 4-Hydroxyphenylglycolate, 4-Hydroxy-DL-mandelate, 4-hydroxy-mandelic acid, Benzeneacetic acid, .alpha.,4-dihydroxy-, delta-4-hydroxymandelate, (RS)-p-Hydroxymandelate, DL-p-Hydroxymandelic acid, DL-p-Hydroxyphenylglycolate, p-Hydroxyphenylglycolic acid, AC1L18ZS, AC1Q5SS0, 4-Hydroxy-DL-mandelic acid, (RS)-p-Hydroxymandelic acid, KSC492Q7N, SCHEMBL352555, alpha,4-Dihydroxybenzeneacetate, racemic parahydroxymandelic acid, AC1Q76K5, AC1Q76K6, DL-p-Hydroxyphenylglycolic acid, alpha,4-dihydroxy-Benzeneacetate, CHEMBL2087618, CTK3J2876, 13244-75-2, alpha,4-dihydroxy-Benzeneacetic acid, EINECS 230-569-2, 8064AF, ANW-45502, MFCD00004234, SBB065018, .alpha.,4-Dihydroxybenzeneacetic acid, 2-(4-Hydroxyphenyl)-2-hydroxyacetate, AKOS009156762, DL-alpha,4-Dihydroxyphenylacetic Acid, Benzeneacetic acid, alpha,4-dihydroxy-, (+/-)-alpha,4-dihydroxy-Benzeneacetate, AC-19775, AK-88708, AN-48855, DS-18506, SC-53438, 2-(4-Hydroxyphenyl)-2-hydroxyacetic acid, AB0071603, HY-113027, RT-001097, ST2404431, (+/-)-alpha,4-dihydroxy-Benzeneacetic acid, CS-0059383, FT-0083192, FT-0618716, FT-0625408, ST50406742, 2-(4-hydroxyphenyl)-2-oxidanyl-ethanoic acid, C11527, A837374, AE-562/40848536, I01-6699, I01-9207, I14-33315, L-p-hydroxymandelate, L-4-hydroxymandelate, (R)-4-Hydroxymandelate, (S)-4-Hydroxymandelate, C8H8O4, CID328, 3-Dimethylallyl-4-hydroxymandelate, P-hydroxy mandelic acid monohydrate, C8-H8-O4, AR-1L0964, 3-Dimethylallyl-4-hydroxymandelic acid, Hydroxy-(4-hydroxy-phenyl)-acetic acid, H0660, 2-(4'-hydroxyphenyl)-2-hydroxyethanoic acid, (R)-2-Hydroxy-2-(4-hydroxyphenyl)acetic acid, 13244-78-5, 184901-84-6, 94509-61-2,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.042g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	168.148g/mol
Monoisotopic Mass	168.042g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	77.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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

Lot Number