CAS
3386-42-3 Purity
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3386-42-3 Purity
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3-(4-CHLOROPHENYL)ISOXAZOL-5-AMINE
CAS
33866-48-7
Catalog Number
ACM33866487
Category
Other Products
Molecular Weight
194.62
Molecular Formula
C9H7ClN2O
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Specification
Synonyms
644943_ALDRICH, ZINC02641165, SBB016692, 5-Amino-3-(4-chlorophenyl)isoxazole, CID2104062, 33866-48-7
IUPAC Name
3-(4-chlorophenyl)-1,2-oxazol-5-amine
Canonical SMILES
C1=CC(=CC=C1C2=NOC(=C2)N)Cl
InChI Key
KRQFEURBUJROHA-UHFFFAOYSA-N
Boiling Point
404.5ºC at 760mmHg
Melting Point
163-167ºC(lit.)
Flash Point
198.5ºC
Density
1.342g/cm³
Exact Mass
194.02500
Hazard Statements
Xn: Harmful;Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
1
Upstream Synthesis Route 1
- 4640-66-8
- 33866-48-7
Reference: [1]Ge, Yun; Sun, Wangbin; Pei, Bingbing; Ding, Jia; Jiang, Yaojia; Loh, Teck-Peng
[Organic Letters, 2018, vol. 20, # 9, p. 2774 - 2777]
Upstream Synthesis Route 2
- 134140-88-8
- 33866-48-7
Reference: [1]Dannhardt; Dominiak; Laufer
[Archiv der Pharmazie, 1991, vol. 324, # 3, p. 141 - 148]
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