CS-0525561
3-((Cyanomethyl)sulfonyl)propanenitrile
Manufacturer: ChemScene
CAS Number: 1267163-64-3
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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
C₅H₆N₂O₂S
Molecular Weight
158.18
Synonyms
3-[(Cyanomethyl)sulfonyl]propanenitrile
SMILES
N#CCCS(=O)(CC#N)=O
Tpsa
81.72
Logp
-0.16154
H Acceptors
4
H Donors
0
Rotatable Bonds
3
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: C₅H₆N₂O₂S
Molecular Weight: 158.18
Synonyms: 3-[(Cyanomethyl)sulfonyl]propanenitrile
SMILES: N#CCCS(=O)(CC#N)=O
Tpsa: 81.72
Logp: -0.16154
H Acceptors: 4
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:
C₅H₆N₂O₂S
Molecular Weight:
158.18
Synonyms:
3-[(Cyanomethyl)sulfonyl]propanenitrile
SMILES:
N#CCCS(=O)(CC#N)=O
Tpsa:
81.72
Logp:
-0.16154
H Acceptors:
4
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: C₁₃H₁₂N₂O₂
Molecular Weight: 228.25
Synonyms: 1H-Indole-2-carboxylic acid, 1-(cyanoMethyl)-, ethyl ester
SMILES: O=C(C(N1CC#N)=CC2=C1C=CC=C2)OCC
Tpsa: 55.02
Logp: 2.34158
H Acceptors: 4
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:
C₁₃H₁₂N₂O₂
Molecular Weight:
228.25
Synonyms:
1H-Indole-2-carboxylic acid, 1-(cyanoMethyl)-, ethyl ester
SMILES:
O=C(C(N1CC#N)=CC2=C1C=CC=C2)OCC
Tpsa:
55.02
Logp:
2.34158
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD19276430
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈F₃NO
Molecular Weight: 215.17
Synonyms: None
SMILES: O=C1NC2=C(C=CC=C2C(F)(F)F)CC1
Tpsa: 29.1
Logp: 2.5901
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD19276430
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₈F₃NO
Molecular Weight:
215.17
Synonyms:
None
SMILES:
O=C1NC2=C(C=CC=C2C(F)(F)F)CC1
Tpsa:
29.1
Logp:
2.5901
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: C₁₃H₁₅NO₃
Molecular Weight: 233.26
Synonyms: None
SMILES: O=C1C(C2=CC=C([N+]([O-])=O)C=C2)CCCCC1
Tpsa: 60.21
Logp: 3.2116
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:
C₁₃H₁₅NO₃
Molecular Weight:
233.26
Synonyms:
None
SMILES:
O=C1C(C2=CC=C([N+]([O-])=O)C=C2)CCCCC1
Tpsa:
60.21
Logp:
3.2116
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2