CS-1036876
4-Methyl-3-(pyrrolidin-3-ylthio)-4H-1,2,4-triazole hydrochloride
Manufacturer: ChemScene
CAS Number: 1864063-26-2
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₇H₁₃ClN₄S
Molecular Weight
220.72
Synonyms
None
SMILES
Cl.N=1N=C(SC2CNCC2)N(C1)C
Tpsa
42.74
Logp
0.6909
H Acceptors
5
H Donors
1
Rotatable Bonds
2
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₃ClN₄S
Molecular Weight: 220.72
Synonyms: None
SMILES: Cl.N=1N=C(SC2CNCC2)N(C1)C
Tpsa: 42.74
Logp: 0.6909
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₃ClN₄S
Molecular Weight:
220.72
Synonyms:
None
SMILES:
Cl.N=1N=C(SC2CNCC2)N(C1)C
Tpsa:
42.74
Logp:
0.6909
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂ClF₂NO
Molecular Weight: 223.65
Synonyms: None
SMILES: Cl.FC1=CC=C(OC(C)CN)C=C1F
Tpsa: 35.25
Logp: 2.1126
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂ClF₂NO
Molecular Weight:
223.65
Synonyms:
None
SMILES:
Cl.FC1=CC=C(OC(C)CN)C=C1F
Tpsa:
35.25
Logp:
2.1126
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₈ClNO₂S
Molecular Weight: 239.76
Synonyms: None
SMILES: Cl.O=C(OC)CCSCC1NCCC1
Tpsa: 38.33
Logp: 1.4565
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₈ClNO₂S
Molecular Weight:
239.76
Synonyms:
None
SMILES:
Cl.O=C(OC)CCSCC1NCCC1
Tpsa:
38.33
Logp:
1.4565
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃KN₃O₃S
Molecular Weight: 306.40
Synonyms: None
SMILES: [K].O=S(=O)(O)C1=NN=C(N1C)CCC=2C=CC=CC2
Tpsa: 85.08
Logp: 0.4662
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃KN₃O₃S
Molecular Weight:
306.40
Synonyms:
None
SMILES:
[K].O=S(=O)(O)C1=NN=C(N1C)CCC=2C=CC=CC2
Tpsa:
85.08
Logp:
0.4662
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4