CS-0907627
2-(2-Chloro-4-hydroxy-5-methylphenyl)-3,3,3-trifluoro-2-methylpropanenitrile
Manufacturer: ChemScene
CAS Number: 3002077-21-3
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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
C₁₁H₉ClF₃NO
Molecular Weight
263.64
Synonyms
None
SMILES
N#CC(C(F)(F)F)(C)C1=CC(C)=C(O)C=C1Cl
Tpsa
44.02
Logp
3.6976
H Acceptors
2
H Donors
1
Rotatable Bonds
1
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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: C₁₁H₉ClF₃NO
Molecular Weight: 263.64
Synonyms: None
SMILES: N#CC(C(F)(F)F)(C)C1=CC(C)=C(O)C=C1Cl
Tpsa: 44.02
Logp: 3.6976
H Acceptors: 2
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:
C₁₁H₉ClF₃NO
Molecular Weight:
263.64
Synonyms:
None
SMILES:
N#CC(C(F)(F)F)(C)C1=CC(C)=C(O)C=C1Cl
Tpsa:
44.02
Logp:
3.6976
H Acceptors:
2
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: C₁₈H₂₆BClO₄
Molecular Weight: 352.66
Synonyms: None
SMILES: O=C(OC)C1=CC(C(C)(C)C)=C(Cl)C=C1B2OC(C)(C)C(C)(C)O2
Tpsa: 44.76
Logp: 3.7233
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:
C₁₈H₂₆BClO₄
Molecular Weight:
352.66
Synonyms:
None
SMILES:
O=C(OC)C1=CC(C(C)(C)C)=C(Cl)C=C1B2OC(C)(C)C(C)(C)O2
Tpsa:
44.76
Logp:
3.7233
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: C₁₆H₂₃BClNO₂
Molecular Weight: 307.62
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=C(C)N=C(C3(C)CC3)C(Cl)=C2)O1
Tpsa: 31.35
Logp: 3.39412
H Acceptors: 3
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:
C₁₆H₂₃BClNO₂
Molecular Weight:
307.62
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=C(C)N=C(C3(C)CC3)C(Cl)=C2)O1
Tpsa:
31.35
Logp:
3.39412
H Acceptors:
3
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: C₁₀H₁₂ClIO
Molecular Weight: 310.56
Synonyms: None
SMILES: OC1=CC(Cl)=C(C(C)(C)C)C=C1I
Tpsa: 20.23
Logp: 3.9477
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:
C₁₀H₁₂ClIO
Molecular Weight:
310.56
Synonyms:
None
SMILES:
OC1=CC(Cl)=C(C(C)(C)C)C=C1I
Tpsa:
20.23
Logp:
3.9477
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0