2-(4-Methylphenyl)acetyl chloride

HCID 2760634CAS 35675-44-6

Basic information

Standard SMILES
Cc1ccc(CC(=O)Cl)cc1
InChIKey
QDZAWVLWIMOXJT-UHFFFAOYSA-N
Molecular formula
C9H9ClO
Average molar mass
168.62 g/mol
Monoisotopic mass
168.0341926

Names & identifiers

Preferred name
2-(4-Methylphenyl)acetyl chloride
IUPAC
2-(4-methylphenyl)acetyl chloride
English name
P-TOLYL-ACETYL CHLORIDE
Molecular formula
C9H9ClO
Molecular weight
168.62

Names & synonyms

2-(4-methylphenyl)acetyl chlorideRefChem:458128673-227-135675-44-6P-Tolyl-Acetyl Chloridep-tolylacetyl chloridep-Tolyl-acetylchlorideMFCD00018813(4-methylphenyl)acetyl chloride4-methyl-phenyl-acetyl chloridestarbld00166734-methylphenylacetylchloride
Show more names
p-Tolylacetylchloride,97+%Benzeneacetyl chloride, 4-methyl-
2-(p-tolyl)acetyl chloridep-methylphenylacetyl chloride2-(4-tolyl)acetyl chloride4-methylphenylacetyl chlorideSCHEMBL657538DTXSID90375274QDZAWVLWIMOXJT-UHFFFAOYSA-N2-(4-methylphenyl) acetylchloride

Database identifiers

CAS
35675-44-6
PubChem CID
2760634
DTXSID
DTXSID90375274
EC Number
673-227-1
Nikkaji
J1.181.608H

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

Boiling point
115 ℃/7.5mm · 115℃/7.5mm
form
Liquid
color
Pink
Sensitive
Moisture Sensitive
UNSPSC Code
12352200 · 12352200
Symbol(GHS)
5 · GHS05

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H290 (16.7%): May be corrosive to metals [Warning Corrosive to Metals];H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (16.7%): Harmful in contact with skin [Warning Acute toxicity, dermal];H314 (83.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H332 (16.7%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (16.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesMet. Corr. 1 (16.7%);Acute Tox. 4 (50%);Acute Tox. 4 (16.7%);Skin Corr. 1B (83.3%);Eye Dam. 1 (50%);Acute Tox. 4 (16.7%);STOT SE 3 (16.7%)

Safety data

ridadr
UN3265
risk_code
22
Signal word
Danger
Symbol(GHS)
GHS05
hazard_code
Xn
hazard_class
8

Chemistry & industry

Applications

UsesP-tolyl-acetyl chloride is an organic synthesis intermediate, mainly used in the field of pharmaceutical research and development.

Upstream & downstream products

Suppliers16 total

南京世洲生物科技有限公司025-025-85560043 17301488900 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州康瑞医药科技有限公司+86-0519-85485169 +86-13961161173 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]

Related reactions

10 records

Linked notes

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