CS-0338028
1-(2,5-Dimethylbenzyl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1281832-74-3
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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
C₁₄H₁₇N₃O₂
Molecular Weight
259.30
Synonyms
None
SMILES
O=C(C1=C(CC)N(CC2=CC(C)=CC=C2C)N=N1)O
Tpsa
68.01
Logp
2.20384
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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: C₁₄H₁₇N₃O₂
Molecular Weight: 259.30
Synonyms: None
SMILES: O=C(C1=C(CC)N(CC2=CC(C)=CC=C2C)N=N1)O
Tpsa: 68.01
Logp: 2.20384
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇N₃O₂
Molecular Weight:
259.30
Synonyms:
None
SMILES:
O=C(C1=C(CC)N(CC2=CC(C)=CC=C2C)N=N1)O
Tpsa:
68.01
Logp:
2.20384
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: MFCD14702881
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₄ClNO₂
Molecular Weight: 191.66
Synonyms: None
SMILES: C[C@H]1CN(C(CCl)=O)C[C@H](O1)C
Tpsa: 29.54
Logp: 0.861
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD14702881
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₄ClNO₂
Molecular Weight:
191.66
Synonyms:
None
SMILES:
C[C@H]1CN(C(CCl)=O)C[C@H](O1)C
Tpsa:
29.54
Logp:
0.861
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂O₃
Molecular Weight: 232.24
Synonyms: 1-[(2-Methoxyphenyl)methyl]-1H-pyrazole-4-carboxylic acid
SMILES: COC1=CC=CC=C1CN2C=C(C=N2)C(=O)O
Tpsa: 64.35
Logp: 1.6382
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂N₂O₃
Molecular Weight:
232.24
Synonyms:
1-[(2-Methoxyphenyl)methyl]-1H-pyrazole-4-carboxylic acid
SMILES:
COC1=CC=CC=C1CN2C=C(C=N2)C(=O)O
Tpsa:
64.35
Logp:
1.6382
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
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=C(C1=NNC=C1)NC(C)C
Tpsa: 57.78
Logp: 0.5479
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:
C₇H₁₁N₃O
Molecular Weight:
153.18
Synonyms:
None
SMILES:
O=C(C1=NNC=C1)NC(C)C
Tpsa:
57.78
Logp:
0.5479
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2