CS-0730236
4-(2-Methoxyethyl)-5-(4-nitrophenyl)-4H-1,2,4-triazole-3-thiol
Manufacturer: ChemScene
CAS Number: 917747-82-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₁₂N₄O₃S
Molecular Weight
280.30
Synonyms
None
SMILES
COCCN1C(=S)NN=C1C1=CC=C(C=C1)[N+]([O-])=O
Tpsa
85.98
Logp
2.16229
H Acceptors
6
H Donors
1
Rotatable Bonds
5
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂N₄O₃S
Molecular Weight: 280.30
Synonyms: None
SMILES: COCCN1C(=S)NN=C1C1=CC=C(C=C1)[N+]([O-])=O
Tpsa: 85.98
Logp: 2.16229
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂N₄O₃S
Molecular Weight:
280.30
Synonyms:
None
SMILES:
COCCN1C(=S)NN=C1C1=CC=C(C=C1)[N+]([O-])=O
Tpsa:
85.98
Logp:
2.16229
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₃NO₂S
Molecular Weight: 295.36
Synonyms: None
SMILES: S=C1NC2=CC3=C(OCO3)C=C2C=C1CC1=CC=CC=C1
Tpsa: 34.25
Logp: 4.21689
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₃NO₂S
Molecular Weight:
295.36
Synonyms:
None
SMILES:
S=C1NC2=CC3=C(OCO3)C=C2C=C1CC1=CC=CC=C1
Tpsa:
34.25
Logp:
4.21689
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₅NOS
Molecular Weight: 281.37
Synonyms: None
SMILES: COC1=CC=C2C=C(CC3=CC=CC=C3)C(=S)NC2=C1
Tpsa: 25.02
Logp: 4.49679
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₅NOS
Molecular Weight:
281.37
Synonyms:
None
SMILES:
COC1=CC=C2C=C(CC3=CC=CC=C3)C(=S)NC2=C1
Tpsa:
25.02
Logp:
4.49679
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₆N₂OS₂
Molecular Weight: 316.44
Synonyms: None
SMILES: CCC1=C(C)SC2=C1C(=S)N=C(N2)C1=CC=C(OC)C=C1
Tpsa: 37.91
Logp: 4.90031
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₆N₂OS₂
Molecular Weight:
316.44
Synonyms:
None
SMILES:
CCC1=C(C)SC2=C1C(=S)N=C(N2)C1=CC=C(OC)C=C1
Tpsa:
37.91
Logp:
4.90031
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3