CS-0600692
(E)-2-((dimethylamino)methylene)-4-methyl-3-oxo-4-(1H-1,2,4-triazol-1-yl)pentanenitrile
Manufacturer: ChemScene
CAS Number: 320420-67-5
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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
C₁₁H₁₅N₅O
Molecular Weight
233.27
Synonyms
None
SMILES
CC(C)(C(=O)/C(=C/N(C)C)/C#N)N1C=NC=N1
Tpsa
74.81
Logp
0.55138
H Acceptors
6
H Donors
0
Rotatable Bonds
4
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: C₁₁H₁₅N₅O
Molecular Weight: 233.27
Synonyms: None
SMILES: CC(C)(C(=O)/C(=C/N(C)C)/C#N)N1C=NC=N1
Tpsa: 74.81
Logp: 0.55138
H Acceptors: 6
H Donors: 0
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:
C₁₁H₁₅N₅O
Molecular Weight:
233.27
Synonyms:
None
SMILES:
CC(C)(C(=O)/C(=C/N(C)C)/C#N)N1C=NC=N1
Tpsa:
74.81
Logp:
0.55138
H Acceptors:
6
H Donors:
0
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: C₁₁H₁₂F₂N₂O
Molecular Weight: 226.22
Synonyms: None
SMILES: CN(C)/C=C/C(=O)NC1=C(C=C(C=C1)F)F
Tpsa: 32.34
Logp: 1.9786
H Acceptors: 2
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:
C₁₁H₁₂F₂N₂O
Molecular Weight:
226.22
Synonyms:
None
SMILES:
CN(C)/C=C/C(=O)NC1=C(C=C(C=C1)F)F
Tpsa:
32.34
Logp:
1.9786
H Acceptors:
2
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: C₁₁H₉ClFN₃O
Molecular Weight: 253.66
Synonyms: None
SMILES: CNC(=O)C1=C(C=NN1C2=CC=C(C=C2)F)Cl
Tpsa: 46.92
Logp: 2.0244
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:
C₁₁H₉ClFN₃O
Molecular Weight:
253.66
Synonyms:
None
SMILES:
CNC(=O)C1=C(C=NN1C2=CC=C(C=C2)F)Cl
Tpsa:
46.92
Logp:
2.0244
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: C₁₄H₁₄ClN₃O
Molecular Weight: 275.73
Synonyms: None
SMILES: CC1=CC=C(C=C1)N2C(=C(C=N2)Cl)C(=O)NC3CC3
Tpsa: 46.92
Logp: 2.72632
H Acceptors: 3
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:
C₁₄H₁₄ClN₃O
Molecular Weight:
275.73
Synonyms:
None
SMILES:
CC1=CC=C(C=C1)N2C(=C(C=N2)Cl)C(=O)NC3CC3
Tpsa:
46.92
Logp:
2.72632
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3