CS-1078081
2-(Methylthio)-4-(prop-1-en-2-yl)pyrimidine-5-carbonitrile
Manufacturer: ChemScene
CAS Number: 2878503-11-6
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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
C₉H₉N₃S
Molecular Weight
191.25
Synonyms
None
SMILES
N#CC1=CN=C(N=C1C(=C)C)SC
Tpsa
49.57
Logp
2.10328
H Acceptors
4
H Donors
0
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: C₉H₉N₃S
Molecular Weight: 191.25
Synonyms: None
SMILES: N#CC1=CN=C(N=C1C(=C)C)SC
Tpsa: 49.57
Logp: 2.10328
H Acceptors: 4
H Donors: 0
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:
C₉H₉N₃S
Molecular Weight:
191.25
Synonyms:
None
SMILES:
N#CC1=CN=C(N=C1C(=C)C)SC
Tpsa:
49.57
Logp:
2.10328
H Acceptors:
4
H Donors:
0
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: C₁₃H₁₇N₃O₃
Molecular Weight: 263.29
Synonyms: None
SMILES: O=C(OC(C)(C)C)NC=1N=C2C(=CC1)C(=O)N(C)C2
Tpsa: 71.53
Logp: 2.0142
H Acceptors: 4
H Donors: 1
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:
C₁₃H₁₇N₃O₃
Molecular Weight:
263.29
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NC=1N=C2C(=CC1)C(=O)N(C)C2
Tpsa:
71.53
Logp:
2.0142
H Acceptors:
4
H Donors:
1
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: C₁₂H₁₄ClN₃O
Molecular Weight: 251.71
Synonyms: None
SMILES: O=C1C2=CC=C(Cl)N=C2N(N1CC=C)C(C)C
Tpsa: 39.82
Logp: 2.6183
H Acceptors: 4
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:
C₁₂H₁₄ClN₃O
Molecular Weight:
251.71
Synonyms:
None
SMILES:
O=C1C2=CC=C(Cl)N=C2N(N1CC=C)C(C)C
Tpsa:
39.82
Logp:
2.6183
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈BrNO₂
Molecular Weight: 254.08
Synonyms: None
SMILES: O(C[C@H]1CO1)C2=C(C#N)C=C(Br)C=C2
Tpsa: 45.55
Logp: 2.09838
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₈BrNO₂
Molecular Weight:
254.08
Synonyms:
None
SMILES:
O(C[C@H]1CO1)C2=C(C#N)C=C(Br)C=C2
Tpsa:
45.55
Logp:
2.09838
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3