CS-1027732
2-(1-Isopropyl-1H-1,2,4-triazol-5-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 1780851-18-4
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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
C₈H₁₃N₃O₂
Molecular Weight
183.21
Synonyms
None
SMILES
O=C(O)C(C1=NC=NN1C(C)C)C
Tpsa
68.01
Logp
1.0471
H Acceptors
4
H Donors
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₃N₃O₂
Molecular Weight: 183.21
Synonyms: None
SMILES: O=C(O)C(C1=NC=NN1C(C)C)C
Tpsa: 68.01
Logp: 1.0471
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:
C₈H₁₃N₃O₂
Molecular Weight:
183.21
Synonyms:
None
SMILES:
O=C(O)C(C1=NC=NN1C(C)C)C
Tpsa:
68.01
Logp:
1.0471
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: C₇H₁₀F₂O₃
Molecular Weight: 180.15
Synonyms: None
SMILES: O=C(O)C1(C)COCCC1(F)F
Tpsa: 46.53
Logp: 1.1329
H Acceptors: 2
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:
C₇H₁₀F₂O₃
Molecular Weight:
180.15
Synonyms:
None
SMILES:
O=C(O)C1(C)COCCC1(F)F
Tpsa:
46.53
Logp:
1.1329
H Acceptors:
2
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: C₈H₅BrO₃
Molecular Weight: 229.03
Synonyms: None
SMILES: O=C1OC2=CC(Br)=CC=C2CO1
Tpsa: 35.53
Logp: 2.4781
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅BrO₃
Molecular Weight:
229.03
Synonyms:
None
SMILES:
O=C1OC2=CC(Br)=CC=C2CO1
Tpsa:
35.53
Logp:
2.4781
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉N₃O
Molecular Weight: 151.17
Synonyms: None
SMILES: O=CC1=C(N=NN1C)C2CC2
Tpsa: 47.78
Logp: 0.505
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉N₃O
Molecular Weight:
151.17
Synonyms:
None
SMILES:
O=CC1=C(N=NN1C)C2CC2
Tpsa:
47.78
Logp:
0.505
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2