AG003KMC

1126-81-4 | N-(4-Sulfanylphenyl)acetamide

AG003KMC

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CAS Number	1126-81-4
Catalog Number	AG003KMC(AGN-PC-0JL9X6)
Chemical Name	N-(4-Sulfanylphenyl)acetamide
EC Number	214-427-7
IUPAC Name	N-(4-sulfanylphenyl)acetamide
InChI	InChI=1S/C8H9NOS/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
InChI Key	AYEQJLOHMLYKAV-UHFFFAOYSA-N
MDL Number	MFCD00004848
Molecular Formula	C8H9NOS
Molecular Weight	167.2282
NSC Number	34851
SMILES	CC(NC1=CC=C(S)C=C1)=O
Synonyms	4-Acetamidothiophenol, 1126-81-4, 4-Acetamidobenzenethiol, 4'-Mercaptoacetanilide, N-(4-mercaptophenyl)acetamide, N-(4-Sulfanylphenyl)acetamide, 4-Acetamido thiophenol, Acetanilide, 4'-mercapto-, 4-Acetaminothiophenol, 4-Mercaptoacetanilide, 4-Acetylaminothiophenol, Acetamide, N-(4-mercaptophenyl)-, p-Acetamidothiophenol, p-Acetaminothiophenol, N-(4-Sulphanylphenyl)acetamide, p-Acetamidobenzenethiol, 4-(Acetylamino)benzenethiol, AYEQJLOHMLYKAV-UHFFFAOYSA-N, 4-Acetamidothiophenol, 95%, 4'-Thioacetanilid, 4'-Thioacetanilide, NSC34851, 4-actamidothiophenol, EINECS 214-427-7, p-mercaptoacetanilide, PubChem6832, 4-acetamido-thiophenol, 4-acetamino-thiophenol, AC1Q5MZJ, Acetanilide, 4-mercapto-, p-acetamidophenyl mercaptan, AC1L2EU4, SCHEMBL272215, ACMC-2099g0, AC1Q1L01, CHEMBL120794, 4-Acetamidothiophenol, >=90%, AYEQJLOHMLYKAV-UHFFFAOYSA-, CTK3J0573, DTXSID60150116, N-(4-Mercapto-phenyl)-acetamide, N-(4-Sulfanylphenyl)acetamide #, ZINC156196, KS-000014QW, ANW-16510, MFCD00004848, NSC-34851, SBB003881, AKOS000120738, MCULE-9967717204, PS-3201, RP23026, TRA0030672, VZ28128, AC-16422, AN-25691, BC210348, BP-20144, N703, DB-041113, RT-004506, ST2407390, TL8006756, FT-0617385, ST50824910, EN300-20933, K-0965, I09-0903, J-002818, J-514277, Z431531592, InChI=1/C8H9NOS/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10), C8H9NOS, 4/'-Mercaptoacetanilide, C8-H9-N-O-S, CID70777, AR-1J9408, 4-Acetamidothiophenol, 95% - 25G 25g, A1389, A1909, 1139-52-2,

Complexity	141
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.04g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	167.226g/mol
Monoisotopic Mass	167.04g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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