CS-0998732
5-(tert-Butyl)-4H-1,2,4-triazole-3-carbaldehyde
Manufacturer: ChemScene
CAS Number: 944897-20-5
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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
C₇H₁₁N₃O
Molecular Weight
153.18
Synonyms
None
SMILES
O=CC1=NN=C(N1)C(C)(C)C
Tpsa
58.64
Logp
0.9147
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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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: C₇H₁₁N₃O
Molecular Weight: 153.18
Synonyms: None
SMILES: O=CC1=NN=C(N1)C(C)(C)C
Tpsa: 58.64
Logp: 0.9147
H Acceptors: 3
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:
C₇H₁₁N₃O
Molecular Weight:
153.18
Synonyms:
None
SMILES:
O=CC1=NN=C(N1)C(C)(C)C
Tpsa:
58.64
Logp:
0.9147
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₅ClN₄
Molecular Weight: 190.67
Synonyms: None
SMILES: NCC1=NN=C(C(C)(C)C)N1.Cl
Tpsa: 67.59
Logp: 0.9827
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₅ClN₄
Molecular Weight:
190.67
Synonyms:
None
SMILES:
NCC1=NN=C(C(C)(C)C)N1.Cl
Tpsa:
67.59
Logp:
0.9827
H Acceptors:
3
H Donors:
2
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: C₁₂H₁₂BrN₃O
Molecular Weight: 294.15
Synonyms: None
SMILES: O=C1C(=C2C(=CN1C3CC3)C(Br)=NN=C2C)C
Tpsa: 47.78
Logp: 2.50574
H Acceptors: 4
H Donors: 0
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:
C₁₂H₁₂BrN₃O
Molecular Weight:
294.15
Synonyms:
None
SMILES:
O=C1C(=C2C(=CN1C3CC3)C(Br)=NN=C2C)C
Tpsa:
47.78
Logp:
2.50574
H Acceptors:
4
H Donors:
0
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: C₁₂H₁₂BrNO₄
Molecular Weight: 314.13
Synonyms: None
SMILES: O=C(OC)C1=CN(C(=O)C(Br)=C1C(=O)C)C2CC2
Tpsa: 65.37
Logp: 1.9349
H Acceptors: 5
H Donors: 0
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:
C₁₂H₁₂BrNO₄
Molecular Weight:
314.13
Synonyms:
None
SMILES:
O=C(OC)C1=CN(C(=O)C(Br)=C1C(=O)C)C2CC2
Tpsa:
65.37
Logp:
1.9349
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3