CS-0693630
3,5-Dicyanobenzeneacetic acid
Manufacturer: ChemScene
CAS Number: 1393585-54-0
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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
C₁₀H₆N₂O₂
Molecular Weight
186.17
Synonyms
None
SMILES
O=C(O)CC1=CC(C#N)=CC(C#N)=C1
Tpsa
84.88
Logp
1.05706
H Acceptors
3
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₆N₂O₂
Molecular Weight: 186.17
Synonyms: None
SMILES: O=C(O)CC1=CC(C#N)=CC(C#N)=C1
Tpsa: 84.88
Logp: 1.05706
H Acceptors: 3
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:
C₁₀H₆N₂O₂
Molecular Weight:
186.17
Synonyms:
None
SMILES:
O=C(O)CC1=CC(C#N)=CC(C#N)=C1
Tpsa:
84.88
Logp:
1.05706
H Acceptors:
3
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: C₁₂H₈Cl₂O₂
Molecular Weight: 255.10
Synonyms: None
SMILES: OC1=C(Cl)C(C2=CC=CC(O)=C2Cl)=CC=C1
Tpsa: 40.46
Logp: 4.0716
H Acceptors: 2
H Donors: 2
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:
C₁₂H₈Cl₂O₂
Molecular Weight:
255.10
Synonyms:
None
SMILES:
OC1=C(Cl)C(C2=CC=CC(O)=C2Cl)=CC=C1
Tpsa:
40.46
Logp:
4.0716
H Acceptors:
2
H Donors:
2
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: C₈H₁₆ClNO
Molecular Weight: 177.67
Synonyms: None
SMILES: OC1(C)CCN(CCCl)CC1
Tpsa: 23.47
Logp: 1.072
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:
C₈H₁₆ClNO
Molecular Weight:
177.67
Synonyms:
None
SMILES:
OC1(C)CCN(CCCl)CC1
Tpsa:
23.47
Logp:
1.072
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: C₈H₁₁NO₄S
Molecular Weight: 217.24
Synonyms: None
SMILES: O=S(OCC1=CC(OC)=NC=C1)(C)=O
Tpsa: 65.49
Logp: 0.5664
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:
C₈H₁₁NO₄S
Molecular Weight:
217.24
Synonyms:
None
SMILES:
O=S(OCC1=CC(OC)=NC=C1)(C)=O
Tpsa:
65.49
Logp:
0.5664
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4