CS-0866651
2-Chloro-4-ethyl-5-methylnicotinonitrile
Manufacturer: ChemScene
CAS Number: 125731-31-9
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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
C₉H₉ClN₂
Molecular Weight
180.63
Synonyms
None
SMILES
N#CC1=C(CC)C(C)=CN=C1Cl
Tpsa
36.68
Logp
2.4775
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₉H₉ClN₂
Molecular Weight: 180.63
Synonyms: None
SMILES: N#CC1=C(CC)C(C)=CN=C1Cl
Tpsa: 36.68
Logp: 2.4775
H Acceptors: 2
H Donors: 0
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:
C₉H₉ClN₂
Molecular Weight:
180.63
Synonyms:
None
SMILES:
N#CC1=C(CC)C(C)=CN=C1Cl
Tpsa:
36.68
Logp:
2.4775
H Acceptors:
2
H Donors:
0
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: C₁₀H₂₀N₂O₂S
Molecular Weight: 232.34
Synonyms: None
SMILES: O=C(N1C[C@@H](CS)NCC1)OC(C)(C)C
Tpsa: 41.57
Logp: 1.1251
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:
C₁₀H₂₀N₂O₂S
Molecular Weight:
232.34
Synonyms:
None
SMILES:
O=C(N1C[C@@H](CS)NCC1)OC(C)(C)C
Tpsa:
41.57
Logp:
1.1251
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉NO₃
Molecular Weight: 167.16
Synonyms: None
SMILES: O=C(C1=CC(OC)=NC(C)=C1)O
Tpsa: 59.42
Logp: 1.09682
H Acceptors: 3
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:
C₈H₉NO₃
Molecular Weight:
167.16
Synonyms:
None
SMILES:
O=C(C1=CC(OC)=NC(C)=C1)O
Tpsa:
59.42
Logp:
1.09682
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: C₁₆H₂₃NO₄
Molecular Weight: 293.36
Synonyms: None
SMILES: CC(OC1=CC=CC=C1)(C)C(OCCN2CCOCC2)=O
Tpsa: 48
Logp: 1.7194
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₃NO₄
Molecular Weight:
293.36
Synonyms:
None
SMILES:
CC(OC1=CC=CC=C1)(C)C(OCCN2CCOCC2)=O
Tpsa:
48
Logp:
1.7194
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
6