CS-0873787
2-Amino-3,5-dimethyl-β,4,6-trioxo-1-cyclohexene-1-propanenitrile
Manufacturer: ChemScene
CAS Number: 887352-46-7
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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
C₁₁H₁₂N₂O₃
Molecular Weight
220.22
Synonyms
None
SMILES
N#CCC(C(C(C1C)=O)=C(N)C(C)C1=O)=O
Tpsa
102.01
Logp
1.15595
H Acceptors
5
H Donors
2
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 887352-46-7 | 3-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-3-oxopropanenitrile | A2B Chem | -- |
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: C₁₁H₁₂N₂O₃
Molecular Weight: 220.22
Synonyms: None
SMILES: N#CCC(C(C(C1C)=O)=C(N)C(C)C1=O)=O
Tpsa: 102.01
Logp: 1.15595
H Acceptors: 5
H Donors: 2
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:
C₁₁H₁₂N₂O₃
Molecular Weight:
220.22
Synonyms:
None
SMILES:
N#CCC(C(C(C1C)=O)=C(N)C(C)C1=O)=O
Tpsa:
102.01
Logp:
1.15595
H Acceptors:
5
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: C₉H₁₃F₃O₃
Molecular Weight: 226.19
Synonyms: None
SMILES: CCOC(=O)[C@](CC(=C)C)(C(F)(F)F)O
Tpsa: 46.53
Logp: 1.8091
H Acceptors: 3
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:
C₉H₁₃F₃O₃
Molecular Weight:
226.19
Synonyms:
None
SMILES:
CCOC(=O)[C@](CC(=C)C)(C(F)(F)F)O
Tpsa:
46.53
Logp:
1.8091
H Acceptors:
3
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: C₁₅H₁₇NO₆S₂
Molecular Weight: 371.43
Synonyms: None
SMILES: COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NCCS(=O)(=S)OC
Tpsa: 94.84
Logp: 0.768
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₇NO₆S₂
Molecular Weight:
371.43
Synonyms:
None
SMILES:
COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NCCS(=O)(=S)OC
Tpsa:
94.84
Logp:
0.768
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
7
Purity: 98%
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: None
SMILES: CCOC(=O)CC(=O)C1=CC2=C(C=C1)C=NN2
Tpsa: 72.05
Logp: 1.6988
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:
C₁₂H₁₂N₂O₃
Molecular Weight:
232.24
Synonyms:
None
SMILES:
CCOC(=O)CC(=O)C1=CC2=C(C=C1)C=NN2
Tpsa:
72.05
Logp:
1.6988
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4