CS-1158638
4-(2-(Methylthio)phenyl)-1H-pyrrole-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 87388-27-0
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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
C₁₂H₁₀N₂S
Molecular Weight
214.29
Synonyms
None
SMILES
N#CC1=CNC=C1C=2C=CC=CC2SC
Tpsa
39.58
Logp
3.27528
H Acceptors
2
H Donors
1
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₀N₂S
Molecular Weight: 214.29
Synonyms: None
SMILES: N#CC1=CNC=C1C=2C=CC=CC2SC
Tpsa: 39.58
Logp: 3.27528
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:
C₁₂H₁₀N₂S
Molecular Weight:
214.29
Synonyms:
None
SMILES:
N#CC1=CNC=C1C=2C=CC=CC2SC
Tpsa:
39.58
Logp:
3.27528
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: C₁₂H₁₁N₃O₂S
Molecular Weight: 261.30
Synonyms: None
SMILES: O=N(=O)C=1C=CC(=CC1)C2=CSC3=NCCCN32
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₁N₃O₂S
Molecular Weight:
261.30
Synonyms:
None
SMILES:
O=N(=O)C=1C=CC(=CC1)C2=CSC3=NCCCN32
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃Cl₂NO₃
Molecular Weight: 220.01
Synonyms: None
SMILES: O=C1OC(O)C=2C=C(Cl)N=C(Cl)C12
Tpsa: 59.42
Logp: 1.5497
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃Cl₂NO₃
Molecular Weight:
220.01
Synonyms:
None
SMILES:
O=C1OC(O)C=2C=C(Cl)N=C(Cl)C12
Tpsa:
59.42
Logp:
1.5497
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₃BrClFO
Molecular Weight: 225.44
Synonyms: None
SMILES: FC1=CC=C(O)C(Br)=C1Cl
Tpsa: 20.23
Logp: 2.9472
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₃BrClFO
Molecular Weight:
225.44
Synonyms:
None
SMILES:
FC1=CC=C(O)C(Br)=C1Cl
Tpsa:
20.23
Logp:
2.9472
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0