CS-0533715
Methyl 5-cyano-4H-1,2,4-triazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 1174005-63-0
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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
C₅H₄N₄O₂
Molecular Weight
152.11
Synonyms
None
SMILES
N#CC1=NN=C(C(OC)=O)N1
Tpsa
91.66
Logp
-0.53702
H Acceptors
5
H Donors
1
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₅H₄N₄O₂
Molecular Weight: 152.11
Synonyms: None
SMILES: N#CC1=NN=C(C(OC)=O)N1
Tpsa: 91.66
Logp: -0.53702
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₄N₄O₂
Molecular Weight:
152.11
Synonyms:
None
SMILES:
N#CC1=NN=C(C(OC)=O)N1
Tpsa:
91.66
Logp:
-0.53702
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₇N₃O
Molecular Weight: 125.13
Synonyms: None
SMILES: O=C1N=CC(N)=CN1C
Tpsa: 60.91
Logp: -0.6375
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₇N₃O
Molecular Weight:
125.13
Synonyms:
None
SMILES:
O=C1N=CC(N)=CN1C
Tpsa:
60.91
Logp:
-0.6375
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD01208092
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₄BrClO₄S
Molecular Weight: 299.53
Synonyms: None
SMILES: O=C(C1=CC(Br)=CC(S(=O)(Cl)=O)=C1)O
Tpsa: 71.44
Logp: 2.0748
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD01208092
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₄BrClO₄S
Molecular Weight:
299.53
Synonyms:
None
SMILES:
O=C(C1=CC(Br)=CC(S(=O)(Cl)=O)=C1)O
Tpsa:
71.44
Logp:
2.0748
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: C₆H₆N₄
Molecular Weight: 134.14
Synonyms: None
SMILES: N#CC1=CC(N)=CN=C1N
Tpsa: 88.72
Logp: 0.11768
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₆N₄
Molecular Weight:
134.14
Synonyms:
None
SMILES:
N#CC1=CC(N)=CN=C1N
Tpsa:
88.72
Logp:
0.11768
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
0