CS-0558470
2-(Benzo[e][1,2,4]triazin-3-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 77475-33-3
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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
C₉H₇N₃O₂
Molecular Weight
189.17
Synonyms
1,2,4-Benzotriazine-3-acetic acid
SMILES
C1=CC=C2C(=C1)N=C(N=N2)CC(=O)O
Tpsa
75.97
Logp
0.6519
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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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
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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: C₉H₇N₃O₂
Molecular Weight: 189.17
Synonyms: 1,2,4-Benzotriazine-3-acetic acid
SMILES: C1=CC=C2C(=C1)N=C(N=N2)CC(=O)O
Tpsa: 75.97
Logp: 0.6519
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:
C₉H₇N₃O₂
Molecular Weight:
189.17
Synonyms:
1,2,4-Benzotriazine-3-acetic acid
SMILES:
C1=CC=C2C(=C1)N=C(N=N2)CC(=O)O
Tpsa:
75.97
Logp:
0.6519
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: C₁₂H₉Br₂NO₃
Molecular Weight: 375.01
Synonyms: 2-Propenoic acid, 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-, ethyl ester
SMILES: CCOC(=O)/C(=C/C1=CC(=C(C(=C1)Br)O)Br)/C#N
Tpsa: 70.32
Logp: 3.38728
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:
C₁₂H₉Br₂NO₃
Molecular Weight:
375.01
Synonyms:
2-Propenoic acid, 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-, ethyl ester
SMILES:
CCOC(=O)/C(=C/C1=CC(=C(C(=C1)Br)O)Br)/C#N
Tpsa:
70.32
Logp:
3.38728
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: C₁₀H₁₀N₄
Molecular Weight: 186.21
Synonyms: None
SMILES: N=1C=CC(=CC1)CNC2=NC=CC=N2
Tpsa: 50.7
Logp: 1.4837
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:
C₁₀H₁₀N₄
Molecular Weight:
186.21
Synonyms:
None
SMILES:
N=1C=CC(=CC1)CNC2=NC=CC=N2
Tpsa:
50.7
Logp:
1.4837
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: C₁₂H₁₆N₄S
Molecular Weight: 248.35
Synonyms: None
SMILES: CCC1=CC2=C(N=CN=C2S1)N3CCNCC3
Tpsa: 41.05
Logp: 1.6633
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:
C₁₂H₁₆N₄S
Molecular Weight:
248.35
Synonyms:
None
SMILES:
CCC1=CC2=C(N=CN=C2S1)N3CCNCC3
Tpsa:
41.05
Logp:
1.6633
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2