CS-1098696
2-(3-Isopropyl-1H-pyrazol-4-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 1368341-42-7
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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
C₈H₁₂N₂O₂
Molecular Weight
168.19
Synonyms
None
SMILES
O=C(O)CC1=CNN=C1C(C)C
Tpsa
65.98
Logp
1.1602
H Acceptors
2
H Donors
2
Rotatable Bonds
3
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: C₈H₁₂N₂O₂
Molecular Weight: 168.19
Synonyms: None
SMILES: O=C(O)CC1=CNN=C1C(C)C
Tpsa: 65.98
Logp: 1.1602
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:
C₈H₁₂N₂O₂
Molecular Weight:
168.19
Synonyms:
None
SMILES:
O=C(O)CC1=CNN=C1C(C)C
Tpsa:
65.98
Logp:
1.1602
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: C₁₆H₂₂BN₃O₃
Molecular Weight: 315.18
Synonyms: None
SMILES: CC(NC1=CC2=C(N(C)C=C2B3OC(C)(C)C(C)(C)O3)C=N1)=O
Tpsa: 65.38
Logp: 1.8309
H Acceptors: 5
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:
C₁₆H₂₂BN₃O₃
Molecular Weight:
315.18
Synonyms:
None
SMILES:
CC(NC1=CC2=C(N(C)C=C2B3OC(C)(C)C(C)(C)O3)C=N1)=O
Tpsa:
65.38
Logp:
1.8309
H Acceptors:
5
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: C₇H₁₁IN₂
Molecular Weight: 250.08
Synonyms: None
SMILES: CC(C1=C(I)NN=C1C)C
Tpsa: 28.68
Logp: 2.44612
H Acceptors: 1
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:
C₇H₁₁IN₂
Molecular Weight:
250.08
Synonyms:
None
SMILES:
CC(C1=C(I)NN=C1C)C
Tpsa:
28.68
Logp:
2.44612
H Acceptors:
1
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: C₁₀H₁₀N₂O₅S
Molecular Weight: 270.26
Synonyms: None
SMILES: O=C1CCCCC1C2=C([N+]([O-])=O)C=C([N+]([O-])=O)S2
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₀N₂O₅S
Molecular Weight:
270.26
Synonyms:
None
SMILES:
O=C1CCCCC1C2=C([N+]([O-])=O)C=C([N+]([O-])=O)S2
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A