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1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE

CAS No.
39552-81-3
Chemical Name:
1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE
Synonyms
2-(4-aminophenyl)propanoate;Benzocaine Impurity 14;METHYL P-AMINOPHENYLACETATE;Methyl 4-aminobenzeneacetate;METHYL-(4-AMINOPHENYL)ACETATE;p-(Methoxycarbonylmethyl)aniline;4-Aminophenylacetic acid methyl ester;Benzeneacetic acid, 4-amino-, methyl ester;1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE;1-(CHLOROMETHYL)-3,5-BIS(METHYLSULPHONYL)BENZENE
CBNumber:
CB5672534
Molecular Formula:
C9H11NO2
Molecular Weight:
165.19
MDL Number:
MFCD06200783
MOL File:
39552-81-3.mol
Last updated:2026-05-28 01:22:27
Product description Number Pack Size Price
Methyl 4-aminophenylacetate 98% OR0171 1g $21
Methyl 4-aminophenylacetate 98% OR0171 5g $24
Methyl-(4-aminophenyl)acetate 012593 25.00g $38
Methyl-(4-aminophenyl)acetate 012593 100.00g $123
Methyl-(4-aminophenyl)acetate 012593 500.00g $606

1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE Properties

Melting point 197-200°C
Boiling point 96-100/0.07mm
Density 1.143±0.06 g/cm3(Predicted)
storage temp. Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
pka 4.36±0.10(Predicted)
form liquid
color Brown
InChI 1S/C9H11NO2/c1-12-9(11)6-7-2-4-8(10)5-3-7/h2-5H,6,10H2,1H3
InChIKey TVIVLENJTXGRAM-UHFFFAOYSA-N
SMILES COC(=O)Cc1ccc(N)cc1
UNSPSC Code 12352200
NACRES NA.21

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Hazard Codes  Xi
Risk Statements  43-52
Safety Statements  36-37
WGK Germany  WGK 3
HazardClass  IRRITANT
HS Code  2922290090
Storage Class 11 - Combustible Solids

1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE price More Price(38)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Apolloscientific OR0171 Methyl 4-aminophenylacetate 98% 39552-81-3 1g $21 2026-06-04 Buy
Apolloscientific OR0171 Methyl 4-aminophenylacetate 98% 39552-81-3 5g $24 2026-06-04 Buy
Matrix Scientific 012593 Methyl-(4-aminophenyl)acetate 39552-81-3 25.00g $38 2026-05-18 Buy
Matrix Scientific 012593 Methyl-(4-aminophenyl)acetate 39552-81-3 100.00g $123 2026-05-18 Buy
Matrix Scientific 012593 Methyl-(4-aminophenyl)acetate 39552-81-3 500.00g $606 2026-05-18 Buy
Product number Packaging Price Buy
OR0171 1g $21 Buy
OR0171 5g $24 Buy
012593 25.00g $38 Buy
012593 100.00g $123 Buy
012593 500.00g $606 Buy

1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE Chemical Properties,Uses,Production

Synthesis

Methanol

67-56-1

4-Aminophenylacetic acid

1197-55-3

1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE

39552-81-3

Synthesis of Intermediate 8a: Methyl 2-(4-aminophenyl)acetate 4-Aminophenylacetic acid (10.0 g, 66.6 mmol) was dissolved in methanol (350 mL), stirred and concentrated. Concentrated sulfuric acid (3.88 mL, 72.77 mmol) was added slowly and dropwise. The reaction mixture was stirred at 50 °C overnight and subsequently cooled to room temperature and concentrated under vacuum. The concentrated mixture was diluted with water, neutralized with sodium carbonate (Na2CO3) until the solid precipitated, and then extracted with dichloromethane (DCM). The organic layer was dried with anhydrous sodium sulfate (Na2SO4), filtered and concentrated to give methyl 2-(4-aminophenyl)acetate (9.75 g, 59.02 mmol, 89% yield). Method 2: RT: 0.60 min, m/z 165.9 [M + H]+.

References

[1] Patent: US2014/303218, 2014, A1. Location in patent: Paragraph 0088-0089
[2] Dalton Transactions, 2018, vol. 47, # 15, p. 5259 - 5268
[3] Patent: WO2016/51193, 2016, A1. Location in patent: Paragraph 00249; 00250; 00251
[4] Bioorganic and Medicinal Chemistry Letters, 2009, vol. 19, # 6, p. 1784 - 1789
[5] Journal of Medicinal Chemistry, 1997, vol. 40, # 7, p. 1049 - 1062

1197-55-3
39552-81-3
Synthesis of 1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE from 4-Aminophenylacetic acid

1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE Suppliers

Global( 93)Suppliers
Supplier Tel Email Country ProdList Advantage
Jinan Carbotang Biotech Co.,Ltd.
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Accela ChemBio Inc.
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Wuhan Chemwish Technology Co., Ltd
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CONIER CHEM AND PHARMA LIMITED
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career henan chemical co
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ANHUI WITOP BIOTECH CO., LTD
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Labnetwork lnc.
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HANGZHOU LEAP CHEM CO., LTD.
+86-571-87711850 market18@leapchem.com China 24597 58
Aromsyn Co., Ltd.
+86-0571-85585865 +8613336024896 CB@aromsyn.com China 19183 58

View Lastest Price from 1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
39552-81-3 pictures 2020-01-08 39552-81-3
39552-81-3
1KG 98%; 99% 1kg; 10kg; 25kg Career Henan Chemical Co
  • 39552-81-3 pictures
  • 39552-81-3
    39552-81-3
  • $0.01
  • 98%; 99%
  • Career Henan Chemical Co

1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE Spectrum

METHYL P-AMINOPHENYLACETATE METHYL-(4-AMINOPHENYL)ACETATE 1-(CHLOROMETHYL)-3,5-BIS(METHYLSULFONYL)BENZENE 1-(CHLOROMETHYL)-3,5-BIS(METHYLSULPHONYL)BENZENE Benzeneacetic acid, 4-amino-, methyl ester p-(Methoxycarbonylmethyl)aniline 4-Aminophenylacetic acid methyl ester Methyl 4-aminobenzeneacetate 4-Aminophenylacetic acid methyl ester, 4-[(Methoxycarbonyl)methyl]aniline 2-(4-aminophenyl)propanoate Benzocaine Impurity 14 39552-81-3 Aromatic Esters