CAS
10098-39-2 Purity
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10098-39-2 Purity
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5-(4-Isopropylphenyl)-1,3,4-thiadiazol-2-amine
CAS
100987-89-1
Catalog Number
ACM100987891
Category
Other Products
Molecular Weight
219.306020 [g/mol]
Molecular Formula
C11H13N3S
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- Product Description
- Case Study
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- Synthetic Use
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Specification
Synonyms
CBMicro_010096, Oprea1_728717, MLS000686559, MolPort-002-085-779, ZINC00449476, HMS1780L22, CID879437, SMR000268201, BIM-0010068.P001, PB86000916, 5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-amine, 100987-89-1
IUPAC Name
5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-amine
Canonical SMILES
CC(C)C1=CC=C(C=C1)C2=NN=C(S2)N
InChI Key
QEKWMJDRQOKJJS-UHFFFAOYSA-N
Boiling Point
369.3ºC at 760mmHg
Flash Point
177.1ºC
Density
1.198g/cm³
Exact Mass
219.08300
H-Bond Acceptor
3
H-Bond Donor
1
Upstream Synthesis Route 1
- 3811-20-9
- 100987-89-1
Reference: [1] Catalysis Letters, 2018, vol. 148, # 11, p. 3486 - 3491
Upstream Synthesis Route 2
- 13816-33-6
- 79-19-6
- 100987-89-1
Reference: [1] Chemical and Pharmaceutical Bulletin, 1992, vol. 40, # 2, p. 357 - 363
Upstream Synthesis Route 3
- 122-03-2
- 100987-89-1
Reference: [1] Catalysis Letters, 2018, vol. 148, # 11, p. 3486 - 3491
Upstream Synthesis Route 4
- 13816-33-6
- 79-19-6
- 100987-89-1
Reference: [1]Chemical and Pharmaceutical Bulletin,1992,vol. 40,p. 357 - 363
Downstream Synthesis Route 1
- 15781-70-1
- 100987-89-1
- 141421-46-7
Reference: [1]Chemical and Pharmaceutical Bulletin,1992,vol. 40,p. 357 - 363
Downstream Synthesis Route 2
- 100987-89-1
- 101367-13-9
Reference: [1]Chemical and Pharmaceutical Bulletin,1992,vol. 40,p. 357 - 363
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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