CS-0806895
2-(4-(Aminomethyl)-2-cyano-3-((trifluoromethyl)thio)phenyl)acetic acid
Manufacturer: ChemScene
CAS Number: 1805504-88-4
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Purity
98%
MDL No
MFCD28727149
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₉F₃N₂O₂S
Molecular Weight
290.26
Synonyms
None
SMILES
O=C(O)CC1=CC=C(CN)C(SC(F)(F)F)=C1C#N
Tpsa
87.11
Logp
2.25598
H Acceptors
4
H Donors
2
Rotatable Bonds
4
Related Products
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: MFCD28727149
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₉F₃N₂O₂S
Molecular Weight: 290.26
Synonyms: None
SMILES: O=C(O)CC1=CC=C(CN)C(SC(F)(F)F)=C1C#N
Tpsa: 87.11
Logp: 2.25598
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD28727149
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₉F₃N₂O₂S
Molecular Weight:
290.26
Synonyms:
None
SMILES:
O=C(O)CC1=CC=C(CN)C(SC(F)(F)F)=C1C#N
Tpsa:
87.11
Logp:
2.25598
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₃BN₂O₃
Molecular Weight: 266.14
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CN(CCOC)N=C2C)O1
Tpsa: 45.51
Logp: 1.13712
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₃BN₂O₃
Molecular Weight:
266.14
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CN(CCOC)N=C2C)O1
Tpsa:
45.51
Logp:
1.13712
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD28785205
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆Cl₂F₂O₂
Molecular Weight: 243.03
Synonyms: None
SMILES: COC1=CC(=C(C=C1OC(F)F)Cl)Cl
Tpsa: 18.46
Logp: 3.6034
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD28785205
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆Cl₂F₂O₂
Molecular Weight:
243.03
Synonyms:
None
SMILES:
COC1=CC(=C(C=C1OC(F)F)Cl)Cl
Tpsa:
18.46
Logp:
3.6034
H Acceptors:
2
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: C₁₆H₂₅BN₂O₃
Molecular Weight: 304.19
Synonyms: None
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=NC(=CC=C2)NC(=O)C(C)(C)C
Tpsa: 60.45
Logp: 2.3654
H Acceptors: 4
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:
C₁₆H₂₅BN₂O₃
Molecular Weight:
304.19
Synonyms:
None
SMILES:
B1(OC(C(O1)(C)C)(C)C)C2=NC(=CC=C2)NC(=O)C(C)(C)C
Tpsa:
60.45
Logp:
2.3654
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2