CS-0877426
6-(Chloromethyl)-2-(m-tolyl)pyrimidin-4(3h)-one
Manufacturer: ChemScene
CAS Number: 680214-71-5
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₁ClN₂O
Molecular Weight
234.68
Synonyms
None
SMILES
CC1=CC(=CC=C1)C2=NC(=CC(=O)N2)CCl
Tpsa
45.75
Logp
2.48412
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P262-P264-P270-P272-P273-P280-P302+P352-P361+P364-P362+P364-P391-P405-P501
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Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁ClN₂O
Molecular Weight: 234.68
Synonyms: None
SMILES: CC1=CC(=CC=C1)C2=NC(=CC(=O)N2)CCl
Tpsa: 45.75
Logp: 2.48412
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₁ClN₂O
Molecular Weight:
234.68
Synonyms:
None
SMILES:
CC1=CC(=CC=C1)C2=NC(=CC(=O)N2)CCl
Tpsa:
45.75
Logp:
2.48412
H Acceptors:
2
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: C₁₃H₁₀ClF₃N₂O₂S
Molecular Weight: 350.74
Synonyms: None
SMILES: C1CN=C(SC1=O)N(C2=CC=CC=C2C(F)(F)F)C(=O)CCl
Tpsa: 49.74
Logp: 3.2967
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:
C₁₃H₁₀ClF₃N₂O₂S
Molecular Weight:
350.74
Synonyms:
None
SMILES:
C1CN=C(SC1=O)N(C2=CC=CC=C2C(F)(F)F)C(=O)CCl
Tpsa:
49.74
Logp:
3.2967
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: C₁₄H₈ClF₃N₂O₃
Molecular Weight: 344.67
Synonyms: None
SMILES: C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(F)(F)F
Tpsa: 72.24
Logp: 4.5193
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:
C₁₄H₈ClF₃N₂O₃
Molecular Weight:
344.67
Synonyms:
None
SMILES:
C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(F)(F)F
Tpsa:
72.24
Logp:
4.5193
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: C₁₇H₉ClF₃NO₃
Molecular Weight: 367.71
Synonyms: None
SMILES: C1=CC=C2C(=C1)C(=O)C(C2=O)(NC(=O)C3=CC=C(C=C3)C(F)(F)F)Cl
Tpsa: 63.24
Logp: 3.4495
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:
C₁₇H₉ClF₃NO₃
Molecular Weight:
367.71
Synonyms:
None
SMILES:
C1=CC=C2C(=C1)C(=O)C(C2=O)(NC(=O)C3=CC=C(C=C3)C(F)(F)F)Cl
Tpsa:
63.24
Logp:
3.4495
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2