AG00068X

102-29-4 | 1,3-Benzenediol, 1-acetate

AG00068X

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CAS Number	102-29-4
Catalog Number	AG00068X(AGN-PC-09TFFC)
Chemical Name	1,3-Benzenediol, 1-acetate
EC Number	203-022-0
IUPAC Name	(3-hydroxyphenyl) acetate
InChI	InChI=1S/C8H8O3/c1-6(9)11-8-4-2-3-7(10)5-8/h2-5,10H,1H3
InChI Key	ZZPKZRHERLGEKA-UHFFFAOYSA-N
MDL Number	MFCD00002266
Molecular Formula	C8H8O3
Molecular Weight	152.1473
SMILES	CC(OC1=CC=CC(O)=C1)=O
UNII	YL6O37RD1S
Synonyms	resorcinol monoacetate, RESORCINOL MONOACETATE, 3-Hydroxyphenyl acetate, 102-29-4, Euresol, Remonol, Acetylresorcinol, 3-Acetoxyphenol, Resorcitate, m-Hydroxyphenyl acetate, 1,3-Benzenediol, monoacetate, Resorcinol, monoacetate, resorcinol acetate, Resorcin monoacetate, 1,3-Benzenediol, 1-acetate, m-Acetoxyphenol, Resorcinol (monoacetate), Resorcin acetate, (3-hydroxyphenyl) acetate, UNII-YL6O37RD1S, NSC 40511, EINECS 203-022-0, BRN 1865490, YL6O37RD1S, Resorcinol monoacetate [USP], AI3-02359, CHEBI:29672, ZZPKZRHERLGEKA-UHFFFAOYSA-N, Acetic Acid 3-Hydroxyphenyl Ester, NCGC00095054-01, DSSTox_CID_25901, DSSTox_RID_81213, DSSTox_GSID_45901, Resorcinol monoacetate (USP), CAS-102-29-4, resorcinacetate, 3-hydroxyphenyl, Resorcinol Monoacetate [USAN], Resorcinmonoacetat, resorcinmonoacetate, Resorcinol, acetate, resorcinolmonoacetate, Euresol (TN), Spectrum_001737, ACMC-20an2g, AC1L1JII, AC1Q1LAX, Spectrum3_000967, Spectrum4_001086, Spectrum5_001091, 3-Hydroxyphenyl acetate #, 1,3-benzenediol monoacetate, 1,3-Benzenediol,1-acetate, 1,3-Benznendiol monoacetate, SCHEMBL27801, BSPBio_002573, KBioGR_001472, KBioSS_002217, 4-06-00-05672 (Beilstein Handbook Reference), DivK1c_000300, SPECTRUM1503500, ZINC2029, CHEMBL1593874, DTXSID6045901, CTK3J4321, HMS500O22, KBio1_000300, KBio2_002217, KBio2_004785, KBio2_007353, KBio3_001793, NINDS_000300, HMS1922C22, HMS2093G09, Pharmakon1600-01503500, Acetic acid 3-hydroxy-phenyl ester, Acetic acid, 3-hydroxyphenyl ester, HY-B0894, NSC40511, Acetylresorcinol;Resorcin monoacetate, Tox21_111406, 8061AF, CCG-40330, MFCD00002266, NSC-40511, NSC758475, AKOS015916482, Tox21_111406_1, NSC-758475, Resorcinol monoacetate, technical grade, IDI1_000300, KS-000015L4, NCGC00095054-02, NCGC00095054-03, NCGC00095054-05, ZB000465, SBI-0051828.P002, LS-143415, RT-001947, FT-0693914, R0009, C12064, D02393, AB00052359_02, SR-05000002069, J-000667, SR-05000002069-1, BRD-K85603128-001-01-9, BRD-K85603128-001-02-7, I14-49954, 1, monoacetate, 3-hydroxyphenylacetat, 3- hydroxyphenyl acetate, C8H8O3, N-(3-Aminophenyl)acetamide, N1-(3-Aminophenyl)acetamide, CID5055, C8-H8-O3, CS-4357, Resorcinol monoacetate, 98% - 100G 100g,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.047g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	152.149g/mol
Monoisotopic Mass	152.047g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H317-H318-H370-H410
Packing Group	Ⅲ
Precautionary statements	P260-P273-P280-P305+P351+P338+P310-P308+P311-P333+P313
UN Code	UN 3082

Certificate of Analysis

Lot Number