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317276

Sigma-Aldrich

Chloroacetaldehyde solution

~55 wt. % in H2O

Synonym(s):

α-Chloroacetaldehyde, 2-Chloro-1-ethanal, 2-Chloroacetaldehyde, 2-Chloroethanal, Monochloroacetaldehyde

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About This Item

Linear Formula:
ClCH2CHO
CAS Number:
107-20-0
Molecular Weight:
78.50
Beilstein:
1071226
EC Number:
203-472-8
MDL number:
MFCD00006992
UNSPSC Code:
12352100
PubChem Substance ID:
24859068
NACRES:
NA.22

form

liquid

Quality Level

200

concentration

~55 wt. % in H2O

refractive index

n20/D 1.4036

density

1.236 g/mL at 25 °C

functional group

aldehyde
chloro

SMILES string

[H]C(=O)CCl

InChI

1S/C2H3ClO/c3-1-2-4/h2H,1H2

InChI key

QSKPIOLLBIHNAC-UHFFFAOYSA-N

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Application

Chloroacetaldehyde solution can be used for the synthesis of:
  • Etheno derivatives of nucleotides.
  • 2,3-Disubstituted pyrroles by Hantzsch reaction.
  • Aminotetrahydronaphthalene ketopiperazine scaffolds as potent MCH-R1 antagonists.

Signal Word

Danger

Hazard Classifications

Acute Tox. 1 Inhalation - Acute Tox. 2 Dermal - Acute Tox. 3 Oral - Aquatic Acute 1 - Carc. 2 - Eye Dam. 1 - Skin Corr. 1B - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 3

Flash Point(F)

143.6 °F - closed cup

Flash Point(C)

62 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

PDSCL

Poisonous substance

FSL

Group 4: Flammable liquids
Type 2 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

317276-1L:4548173133720
317276-5ML:4548173133744
317276-VAR:
317276-BULK:
317276-250ML:4548173133737

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Certificates of Analysis (COA)

Lot/Batch Number
BCCL9777
BCCK3474
BCCJ4501
BCCG3690
BCCB0072

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Novel synthesis of [13C4, 15N] 1H-pyrrole-2, 3, 5-tricarboxylic acid: an important biomarker for melatonin metabolism
Skaddan MB
Journal of Labelled Compounds & Radiopharmaceuticals, 53(2), 73-77 (2010)
Determination of leukocyte DNA 6-thioguanine nucleotide levels by high-performance liquid chromatography with fluorescence detection
Olesen KM, et al.
Journal of Chromatography. B, Biomedical Applications, 864(1-2), 149-155 (2008)
The efficacy and cardiac evaluation of aminomethyl tetrahydronaphthalene ketopiperazines: a novel class of potent MCH-R1 antagonists
Mendez-Andino JL, et al.
Bioorganic & Medicinal Chemistry, 15(5), 2092-2105 (2007)
Stephanie L MacAllister et al.
Chemico-biological interactions, 202(1-3), 259-266 (2012-12-12)
Cyclophosphamide and ifosfamide are two commonly used DNA-alkylating agents in cancer chemotherapy that undergo biotransformation to several toxic and non-toxic metabolites, including acrolein and chloroacetaldehyde (CAA). Acrolein and CAA toxicities occur by several different mechanisms, including ROS formation and protein
Min Young Kim et al.
Chemical research in toxicology, 20(8), 1075-1083 (2007-07-31)
2-Chloroacetaldehyde (CAA), a metabolite of the carcinogen vinyl chloride, reacts with DNA to form cyclic etheno ()-lesions. AlkB, an iron-/alpha-ketoglutarate-dependent dioxygenase, repairs 1, N (6)-ethenodeoxyadenosine (A) and 3, N (4)-ethenodeoxycytidine (C) in site-specifically modified single-stranded viral genomes in vivo and
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