Home Carboxes 102-29-4
102-29-4,MFCD00002266
Catalog No.:AA000665
102-29-4 | 1,3-Benzenediol, 1-acetate
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25g
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$144.00   $101.00
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500g
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  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000665
Chemical Name:
1,3-Benzenediol, 1-acetate
CAS Number:
102-29-4
Molecular Formula:
C8H8O3
Molecular Weight:
152.1473
MDL Number:
MFCD00002266
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
SMILES:
CC(=O)Oc1cccc(c1)O
EC Number:
203-022-0
UNII:
YL6O37RD1S
Properties
Computed Properties
 
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  

Synonyms
 
resorcinol monoacetate 
RESORCINOL MONOACETATE 
1,3-Benzenediol, monoacetate 
R0009 
C12064 
D02393 
AB00052359_02 
SR-05000002069 
J-000667 
SR-05000002069-1 
BRD-K85603128-001-01-9 
BRD-K85603128-001-02-7 
I14-49954 
Resorcinol, monoacetate 
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 
resorcinol acetate 
Resorcin monoacetate 
1,3-Benzenediol, 1-acetate 
m-Acetoxyphenol 
Resorcinol (monoacetate) 
Resorcin acetate 
(3-hydroxyphenyl) acetate 
UNII-YL6O37RD1S 
3-Hydroxyphenyl acetate 
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 
102-29-4 
DSSTox_CID_25901 
DSSTox_RID_81213 
DSSTox_GSID_45901 
Resorcinol monoacetate (USP) 
CAS-102-29-4 
resorcinacetate 
3-hydroxyphenyl 
Resorcinol Monoacetate [USAN] 
Resorcinmonoacetat 
resorcinmonoacetate 
Euresol 
Resorcinol, acetate 
resorcinolmonoacetate 
Euresol (TN) 
Spectrum_001737 
ACMC-20an2g 
AC1L1JII 
AC1Q1LAX 
Spectrum3_000967 
Spectrum4_001086 
Spectrum5_001091 
Remonol 
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 
Acetylresorcinol 
SPECTRUM1503500 
ZINC2029 
CHEMBL1593874 
DTXSID6045901 
CTK3J4321 
HMS500O22 
KBio1_000300 
KBio2_002217 
KBio2_004785 
KBio2_007353 
3-Acetoxyphenol 
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 
Resorcitate 
Tox21_111406 
8061AF 
CCG-40330 
MFCD00002266 
NSC-40511 
NSC758475 
AKOS015916482 
Tox21_111406_1 
NSC-758475 
Resorcinol monoacetate, technical grade 
m-Hydroxyphenyl acetate 
IDI1_000300 
KS-000015L4 
NCGC00095054-02 
NCGC00095054-03 
NCGC00095054-05 
ZB000465 
SBI-0051828.P002 
LS-143415 
RT-001947 
FT-0693914 
Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Classification of benzoyl peroxide as safe and effective and revision of labeling to drug facts format; topical acne drug products for over-the-counter human use; final rule.

Journal: Federal register 20100304

Title: The complete multipartite genome sequence of Cupriavidus necator JMP134, a versatile pollutant degrader.

Journal: PloS one 20100101

Title: A two-component hydroxylase involved in the assimilation of 3-hydroxyphenyl acetate in Pseudomonas putida.

Journal: The Journal of biological chemistry 20050715

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