CS-0895699
5-Cyclopropyl-1-(methylsulfonyl)-1H-1,2,3-triazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1997216-78-0
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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
C₇H₉N₃O₄S
Molecular Weight
231.23
Synonyms
None
SMILES
O=C(C1=C(C2CC2)N(S(=O)(C)=O)N=N1)O
Tpsa
102.15
Logp
-0.3386
H Acceptors
6
H Donors
1
Rotatable Bonds
3
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉N₃O₄S
Molecular Weight: 231.23
Synonyms: None
SMILES: O=C(C1=C(C2CC2)N(S(=O)(C)=O)N=N1)O
Tpsa: 102.15
Logp: -0.3386
H Acceptors: 6
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:
C₇H₉N₃O₄S
Molecular Weight:
231.23
Synonyms:
None
SMILES:
O=C(C1=C(C2CC2)N(S(=O)(C)=O)N=N1)O
Tpsa:
102.15
Logp:
-0.3386
H Acceptors:
6
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: C₁₄H₁₃N₃O₄
Molecular Weight: 287.27
Synonyms: None
SMILES: O=CC1=CC=C2C(N(C3C(NC(CC3)=O)=O)C(N2C)=O)=C1
Tpsa: 90.17
Logp: 0.1302
H Acceptors: 6
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:
C₁₄H₁₃N₃O₄
Molecular Weight:
287.27
Synonyms:
None
SMILES:
O=CC1=CC=C2C(N(C3C(NC(CC3)=O)=O)C(N2C)=O)=C1
Tpsa:
90.17
Logp:
0.1302
H Acceptors:
6
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: C₁₃H₁₇F₂NO
Molecular Weight: 241.28
Synonyms: None
SMILES: O[C@H]1C(F)(F)CC[C@@H](NCC2=CC=CC=C2)C1
Tpsa: 32.26
Logp: 2.3249
H Acceptors: 2
H Donors: 2
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:
C₁₃H₁₇F₂NO
Molecular Weight:
241.28
Synonyms:
None
SMILES:
O[C@H]1C(F)(F)CC[C@@H](NCC2=CC=CC=C2)C1
Tpsa:
32.26
Logp:
2.3249
H Acceptors:
2
H Donors:
2
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: C₁₅H₂₄BClFNO₂
Molecular Weight: 315.62
Synonyms: None
SMILES: FC1=C(C=CC([C@H](N)C)=C1C)B2OC(C)(C(C)(O2)C)C.Cl
Tpsa: 44.48
Logp: 2.87482
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:
C₁₅H₂₄BClFNO₂
Molecular Weight:
315.62
Synonyms:
None
SMILES:
FC1=C(C=CC([C@H](N)C)=C1C)B2OC(C)(C(C)(O2)C)C.Cl
Tpsa:
44.48
Logp:
2.87482
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2