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Merck

C27409

4-Chlorobenzylamine

98%

Synonym(s):

(4-Chlorophenyl)methanamine, (4-Chlorophenyl)methylamine, (p-Aminomethyl)phenyl chloride, (p-Chlorophenyl)methylamine, 1-(4-Chlorophenyl)methanamine, 4-Chlorobenzenemethanamine, p-Chlorobenzenemethanamine, p-Chlorobenzylamine

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About This Item

Linear Formula:
ClC6H4CH2NH2
CAS Number:
104-86-9
Molecular Weight:
141.60
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24892522
EC Number:
203-245-3
Beilstein/REAXYS Number:
507949
MDL number:
MFCD00008121
Assay:
98%
Form:
liquid

Key Documents

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InChI key

YMVFJGSXZNNUDW-UHFFFAOYSA-N

InChI

1S/C7H8ClN/c8-7-3-1-6(5-9)2-4-7/h1-4H,5,9H2

SMILES string

NCc1ccc(Cl)cc1

assay

98%

form

liquid

refractive index

n20/D 1.558 (lit.)

bp

215 °C (lit.)

density

1.164 g/mL at 25 °C (lit.)

Quality Level

100

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pictograms

CorrosionExclamation mark
GHS05,GHS07

signalword

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Eye Dam. 1 - Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

194.0 °F - closed cup

flash_point_c

90 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

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Certificates of Analysis (COA)

Lot/Batch Number
WXBF7961V
WXBF1900
STBK6064
STBH1967
STBH0945

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Stephen R Davies et al.
Drug testing and analysis, 11(2), 257-266 (2018-08-22)
Two human metabolites of the REV-ERB agonist SR9009, identified by researchers with an interest in sports doping control, have been synthesized and assessed for purity. The synthesis employed was a modification of published procedures for the parent SR9009, careful attention
Kenji Matsuno et al.
Bioorganic & medicinal chemistry letters, 20(17), 5126-5129 (2010-08-07)
S-benzylisothiourea 3a was discovered by its ability to inhibit indoleamine-2,3-dioxygenase (IDO) in our screening program. Subsequent optimization of the initial hit 3a lead to the identification of sub-muM inhibitors 3r and 10h, both of which suppressed kynurenine production in A431

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