CS-1060053
4-Chloro-2-(1H-pyrrol-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 862595-50-4
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₇ClN₂
Molecular Weight
202.64
Synonyms
None
SMILES
N#CC1=CC=C(Cl)C=C1N2C=CC=C2
Tpsa
28.72
Logp
3.00238
H Acceptors
2
H Donors
0
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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₇ClN₂
Molecular Weight: 202.64
Synonyms: None
SMILES: N#CC1=CC=C(Cl)C=C1N2C=CC=C2
Tpsa: 28.72
Logp: 3.00238
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₇ClN₂
Molecular Weight:
202.64
Synonyms:
None
SMILES:
N#CC1=CC=C(Cl)C=C1N2C=CC=C2
Tpsa:
28.72
Logp:
3.00238
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: C₁₅H₁₈BNO₄
Molecular Weight: 287.12
Synonyms: None
SMILES: O=C1C2=CC=C(C=C2C(=O)N1C)B3OC(C)(C)C(O3)(C)C
Tpsa: 55.84
Logp: 1.2116
H Acceptors: 4
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:
C₁₅H₁₈BNO₄
Molecular Weight:
287.12
Synonyms:
None
SMILES:
O=C1C2=CC=C(C=C2C(=O)N1C)B3OC(C)(C)C(O3)(C)C
Tpsa:
55.84
Logp:
1.2116
H Acceptors:
4
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: C₁₁H₂₂O₃S
Molecular Weight: 234.36
Synonyms: None
SMILES: C(C/C=C\CCCCC)COS(C)(=O)=O
Tpsa: 43.37
Logp: 2.8793
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₂₂O₃S
Molecular Weight:
234.36
Synonyms:
None
SMILES:
C(C/C=C\CCCCC)COS(C)(=O)=O
Tpsa:
43.37
Logp:
2.8793
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
9
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈N₂O₄
Molecular Weight: 184.15
Synonyms: None
SMILES: O=C(O)C=1N=CN(C1C(=O)O)CC
Tpsa: 92.42
Logp: 0.2994
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈N₂O₄
Molecular Weight:
184.15
Synonyms:
None
SMILES:
O=C(O)C=1N=CN(C1C(=O)O)CC
Tpsa:
92.42
Logp:
0.2994
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3