CS-1009878
(E)-3-(3,5-Dimethyl-1H-1,2,4-triazol-1-yl)acrylic acid
Manufacturer: ChemScene
CAS Number: 2660015-29-0
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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
C₇H₉N₃O₂
Molecular Weight
167.17
Synonyms
None
SMILES
O=C(O)C=CN1N=C(N=C1C)C
Tpsa
68.01
Logp
0.45024
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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: C₇H₉N₃O₂
Molecular Weight: 167.17
Synonyms: None
SMILES: O=C(O)C=CN1N=C(N=C1C)C
Tpsa: 68.01
Logp: 0.45024
H Acceptors: 4
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:
C₇H₉N₃O₂
Molecular Weight:
167.17
Synonyms:
None
SMILES:
O=C(O)C=CN1N=C(N=C1C)C
Tpsa:
68.01
Logp:
0.45024
H Acceptors:
4
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: C₈H₈BrNO
Molecular Weight: 214.06
Synonyms: None
SMILES: O=C(CBr)CC=1C=CN=CC1
Tpsa: 29.96
Logp: 1.5881
H Acceptors: 2
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:
C₈H₈BrNO
Molecular Weight:
214.06
Synonyms:
None
SMILES:
O=C(CBr)CC=1C=CN=CC1
Tpsa:
29.96
Logp:
1.5881
H Acceptors:
2
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: C₅H₄ClN₃O₂
Molecular Weight: 173.56
Synonyms: None
SMILES: O=C(O)C=CN1N=C(Cl)N=C1
Tpsa: 68.01
Logp: 0.4868
H Acceptors: 4
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:
C₅H₄ClN₃O₂
Molecular Weight:
173.56
Synonyms:
None
SMILES:
O=C(O)C=CN1N=C(Cl)N=C1
Tpsa:
68.01
Logp:
0.4868
H Acceptors:
4
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: C₇H₅F₃N₂O₂
Molecular Weight: 206.12
Synonyms: None
SMILES: O=C(O)C=CN1C=NC(=C1)C(F)(F)F
Tpsa: 55.12
Logp: 1.4572
H Acceptors: 3
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:
C₇H₅F₃N₂O₂
Molecular Weight:
206.12
Synonyms:
None
SMILES:
O=C(O)C=CN1C=NC(=C1)C(F)(F)F
Tpsa:
55.12
Logp:
1.4572
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2