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4-Acetamido-2-methylphenol

HCID 85384
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
16375-90-9
Standard SMILES
CC(=O)Nc1ccc(O)c(C)c1
InChIKey
AVIDZQVUWISHES-UHFFFAOYSA-N
Molecular formula
C9H11NO2
Average molar mass
165.19 g/mol
Monoisotopic mass
165.07897859

Names & identifiers

Preferred name
4-Acetamido-2-methylphenol
IUPAC
N-(4-hydroxy-3-methylphenyl)acetamide
English name
3-methylacetaminophen
Molecular formula
C9H11NO2
Molecular weight
165.19

Names & synonyms

16375-90-9Acetamide, N-(4-hydroxy-3-methylphenyl)-3-Methylacetaminophen4-Hydroxy-3-methylacetanilide4'-Hydroxy-m-acetotoluidide3-Methyl-4-hydroxyacetanilidem-Acetotoluidide, 4'-hydroxy-SD40BP2DRF4-acetamido-2-methylphenolNSC-166003-METHYLPARACETAMOLDTXSID4066040
Show more names
3'-Methyl-4'-hydroxyacetoanilide
RefChem:94824DTXCID9035256N-(4-hydroxy-3-methylphenyl)acetamideMFCD00600560NSC 16600UNII-SD40BP2DRFACETAMIDE,N-(4-HYDROXY-3-METHYLPHENYL)-CHEMBL48323

Database identifiers

CAS
16375-90-9
PubChem CID
85384
DTXSID
DTXSID4066040
ChEMBL
CHEMBL48323
UNII
SD40BP2DRF
EC Number
895-768-4
Nikkaji
J421.963E

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
49.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
170

Experimental & physicochemical properties

LogP0.79

Physicochemical properties

Melting point
181 · 181-183 °C
Boiling point
293.03 °C · 293.03°C (rough estimate)
Density
1.1603 · 1.1603 (rough estimate)
refractive index
1.527 · 1.5270 (estimate)
storage temp.
Sealed in dry,Room Temperature
pka
10.26 · 10.26±0.18(Predicted)
Water Solubility
4.189 g/L · 4.189g/L(25 ºC)
FDA UNII
40 BP2DRF · SD40BP2DRF
EPA Substance Registry System
Acetamide, N-(4-hydroxy-3-methylphenyl)- (16375-90-9)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationAcetamide, N-(4-hydroxy-3-methylphenyl)-: INACTIVE

Upstream & downstream products

Downstream products

4-methoxy-3-methylaniline

Suppliers13 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
盐城康迪森医药科技有限公司13812573443;18052965989 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology

Related reactions

1 records
New reaction record
HRID 1597818 reaction equation
HRID 1597818As reactantuspto-grants-1998_04

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Precautionary statements
261 · P261-P305+P351+P338
TSCA
TSCA listed
18143011203 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海锲诺医药科技有限公司021-021-51557188 15901710861 · [email protected]