CS-0167704
3-(3,5-Dimethylbenzofuran-2-yl)-3-oxopropanenitrile
Manufacturer: ChemScene
CAS Number: 2061980-32-1
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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
C₁₃H₁₁NO₂
Molecular Weight
213.23
Synonyms
None
SMILES
CC1=CC=C2OC(C(CC#N)=O)=C(C2=C1)C
Tpsa
54
Logp
3.14602
H Acceptors
3
H Donors
0
Rotatable Bonds
2
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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: C₁₃H₁₁NO₂
Molecular Weight: 213.23
Synonyms: None
SMILES: CC1=CC=C2OC(C(CC#N)=O)=C(C2=C1)C
Tpsa: 54
Logp: 3.14602
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:
C₁₃H₁₁NO₂
Molecular Weight:
213.23
Synonyms:
None
SMILES:
CC1=CC=C2OC(C(CC#N)=O)=C(C2=C1)C
Tpsa:
54
Logp:
3.14602
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₅₀N₂O₁₆
Molecular Weight: 706.73
Synonyms: None
SMILES: O=C1C=CC(N1CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(ON2C(CCC2=O)=O)=O)=O
Tpsa: 193.36
Logp: -0.9253
H Acceptors: 16
H Donors: 0
Rotatable Bonds: 34
Purity:
95%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₅₀N₂O₁₆
Molecular Weight:
706.73
Synonyms:
None
SMILES:
O=C1C=CC(N1CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(ON2C(CCC2=O)=O)=O)=O
Tpsa:
193.36
Logp:
-0.9253
H Acceptors:
16
H Donors:
0
Rotatable Bonds:
34
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₄N₂O₈
Molecular Weight: 372.37
Synonyms: None
SMILES: O=C(O)CCOCCOCCOCCNC(CCN1C(C=CC1=O)=O)=O
Tpsa: 131.47
Logp: -1.0578
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₄N₂O₈
Molecular Weight:
372.37
Synonyms:
None
SMILES:
O=C(O)CCOCCOCCOCCNC(CCN1C(C=CC1=O)=O)=O
Tpsa:
131.47
Logp:
-1.0578
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₇N₃O₁₀
Molecular Weight: 469.44
Synonyms: None
SMILES: O=C(CCOCCOCCOCCNC(CCN1C(C=CC1=O)=O)=O)ON2C(CCC2=O)=O
Tpsa: 157.85
Logp: -1.5352
H Acceptors: 10
H Donors: 1
Rotatable Bonds: 16
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₇N₃O₁₀
Molecular Weight:
469.44
Synonyms:
None
SMILES:
O=C(CCOCCOCCOCCNC(CCN1C(C=CC1=O)=O)=O)ON2C(CCC2=O)=O
Tpsa:
157.85
Logp:
-1.5352
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
16