CS-1017556
4-Isobutyl-4H-1,2,4-triazole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1557735-31-5
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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
C₇H₁₁N₃O₂
Molecular Weight
169.18
Synonyms
None
SMILES
O=C(O)C1=NN=CN1CC(C)C
Tpsa
68.01
Logp
0.6323
H Acceptors
4
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁N₃O₂
Molecular Weight: 169.18
Synonyms: None
SMILES: O=C(O)C1=NN=CN1CC(C)C
Tpsa: 68.01
Logp: 0.6323
H Acceptors: 4
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:
C₇H₁₁N₃O₂
Molecular Weight:
169.18
Synonyms:
None
SMILES:
O=C(O)C1=NN=CN1CC(C)C
Tpsa:
68.01
Logp:
0.6323
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: C₁₀H₁₄ClNO
Molecular Weight: 199.68
Synonyms: None
SMILES: OCC1(C2=CC=C(N)C=C2)CC1.Cl
Tpsa: 46.25
Logp: 1.7145
H Acceptors: 2
H Donors: 2
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:
C₁₀H₁₄ClNO
Molecular Weight:
199.68
Synonyms:
None
SMILES:
OCC1(C2=CC=C(N)C=C2)CC1.Cl
Tpsa:
46.25
Logp:
1.7145
H Acceptors:
2
H Donors:
2
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: C₈H₉NO₂
Molecular Weight: 151.16
Synonyms: None
SMILES: O=C(O)C1C2=CNC=C2CC1
Tpsa: 53.09
Logp: 1.1291
H Acceptors: 1
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:
C₈H₉NO₂
Molecular Weight:
151.16
Synonyms:
None
SMILES:
O=C(O)C1C2=CNC=C2CC1
Tpsa:
53.09
Logp:
1.1291
H Acceptors:
1
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: C₉H₈BrClO
Molecular Weight: 247.52
Synonyms: None
SMILES: ClC1=CC(Br)=CC=C1C2(OC2)C
Tpsa: 12.53
Logp: 3.3479
H Acceptors: 1
H Donors: 0
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:
C₉H₈BrClO
Molecular Weight:
247.52
Synonyms:
None
SMILES:
ClC1=CC(Br)=CC=C1C2(OC2)C
Tpsa:
12.53
Logp:
3.3479
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1