CS-1101340
7-(Cyanomethyl)benzo[d][1,3]dioxole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 3038251-43-0
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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
C₁₀H₇NO₄
Molecular Weight
205.17
Synonyms
None
SMILES
O=C(C1=CC(CC#N)=C(OCO2)C2=C1)O
Tpsa
79.55
Logp
1.17958
H Acceptors
4
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: C₁₀H₇NO₄
Molecular Weight: 205.17
Synonyms: None
SMILES: O=C(C1=CC(CC#N)=C(OCO2)C2=C1)O
Tpsa: 79.55
Logp: 1.17958
H Acceptors: 4
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:
C₁₀H₇NO₄
Molecular Weight:
205.17
Synonyms:
None
SMILES:
O=C(C1=CC(CC#N)=C(OCO2)C2=C1)O
Tpsa:
79.55
Logp:
1.17958
H Acceptors:
4
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: C₁₀H₇Cl₂N₃
Molecular Weight: 240.09
Synonyms: None
SMILES: NC1=CN=C(C2=CC=C(Cl)C=C2Cl)N=C1
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:
C₁₀H₇Cl₂N₃
Molecular Weight:
240.09
Synonyms:
None
SMILES:
NC1=CN=C(C2=CC=C(Cl)C=C2Cl)N=C1
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆O₂
Molecular Weight: 192.25
Synonyms: None
SMILES: O=C(O)CCC1=CC(C)=C(C)C=C1C
Tpsa: 37.3
Logp: 2.62906
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₆O₂
Molecular Weight:
192.25
Synonyms:
None
SMILES:
O=C(O)CCC1=CC(C)=C(C)C=C1C
Tpsa:
37.3
Logp:
2.62906
H Acceptors:
1
H Donors:
1
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: C₇H₃F₄NO
Molecular Weight: 193.10
Synonyms: None
SMILES: O=CC1=CC(F)=NC=C1C(F)(F)F
Tpsa: 29.96
Logp: 2.052
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:
C₇H₃F₄NO
Molecular Weight:
193.10
Synonyms:
None
SMILES:
O=CC1=CC(F)=NC=C1C(F)(F)F
Tpsa:
29.96
Logp:
2.052
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1