CS-0527161
Methyl 6-cyano-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Manufacturer: ChemScene
CAS Number: 2757339-22-1
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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
C₇H₇N₃O₂S
Molecular Weight
197.21
Synonyms
None
SMILES
O=C(C(CN1)=C(C#N)NC1=S)OC
Tpsa
74.15
Logp
-0.58522
H Acceptors
4
H Donors
2
Rotatable Bonds
1
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: C₇H₇N₃O₂S
Molecular Weight: 197.21
Synonyms: None
SMILES: O=C(C(CN1)=C(C#N)NC1=S)OC
Tpsa: 74.15
Logp: -0.58522
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₇N₃O₂S
Molecular Weight:
197.21
Synonyms:
None
SMILES:
O=C(C(CN1)=C(C#N)NC1=S)OC
Tpsa:
74.15
Logp:
-0.58522
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃N₃
Molecular Weight: 199.25
Synonyms: None
SMILES: N#CC(C)(C)C1=NC=C(NCC#C)C=C1
Tpsa: 48.71
Logp: 1.92788
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:
C₁₂H₁₃N₃
Molecular Weight:
199.25
Synonyms:
None
SMILES:
N#CC(C)(C)C1=NC=C(NCC#C)C=C1
Tpsa:
48.71
Logp:
1.92788
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: C₈H₄BrFIN
Molecular Weight: 339.93
Synonyms: None
SMILES: IC(N1)=CC2=C1C=C(F)C=C2Br
Tpsa: 15.79
Logp: 3.6741
H Acceptors: 0
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄BrFIN
Molecular Weight:
339.93
Synonyms:
None
SMILES:
IC(N1)=CC2=C1C=C(F)C=C2Br
Tpsa:
15.79
Logp:
3.6741
H Acceptors:
0
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃BrClIN₂
Molecular Weight: 357.37
Synonyms: None
SMILES: IC(N1)=CC2=C1C(Cl)=NC=C2Br
Tpsa: 28.68
Logp: 3.5834
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃BrClIN₂
Molecular Weight:
357.37
Synonyms:
None
SMILES:
IC(N1)=CC2=C1C(Cl)=NC=C2Br
Tpsa:
28.68
Logp:
3.5834
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0