CS-0529131
3-(2-(tert-Butoxy)ethoxy)-4-nitrobenzoic acid
Manufacturer: ChemScene
CAS Number: 1775687-16-5
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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
C₁₃H₁₇NO₆
Molecular Weight
283.28
Synonyms
None
SMILES
O=C(O)C1=CC=C([N+]([O-])=O)C(OCCOC(C)(C)C)=C1
Tpsa
98.9
Logp
2.4869
H Acceptors
5
H Donors
1
Rotatable Bonds
6
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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: C₁₃H₁₇NO₆
Molecular Weight: 283.28
Synonyms: None
SMILES: O=C(O)C1=CC=C([N+]([O-])=O)C(OCCOC(C)(C)C)=C1
Tpsa: 98.9
Logp: 2.4869
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇NO₆
Molecular Weight:
283.28
Synonyms:
None
SMILES:
O=C(O)C1=CC=C([N+]([O-])=O)C(OCCOC(C)(C)C)=C1
Tpsa:
98.9
Logp:
2.4869
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₉NO₃
Molecular Weight: 143.14
Synonyms: 3-tert-butyl-1,4,2-dioxazol-5-one
SMILES: O=C1OC(C(C)(C)C)=NO1
Tpsa: 56.24
Logp: 0.9253
H Acceptors: 4
H Donors: 0
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:
C₆H₉NO₃
Molecular Weight:
143.14
Synonyms:
3-tert-butyl-1,4,2-dioxazol-5-one
SMILES:
O=C1OC(C(C)(C)C)=NO1
Tpsa:
56.24
Logp:
0.9253
H Acceptors:
4
H Donors:
0
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: C₁₃H₉N
Molecular Weight: 179.22
Synonyms: None
SMILES: C#CC1=CC=C(C2=CC=CN=C2)C=C1
Tpsa: 12.89
Logp: 2.7299
H Acceptors: 1
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:
C₁₃H₉N
Molecular Weight:
179.22
Synonyms:
None
SMILES:
C#CC1=CC=C(C2=CC=CN=C2)C=C1
Tpsa:
12.89
Logp:
2.7299
H Acceptors:
1
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: C₁₁H₁₂INO
Molecular Weight: 301.12
Synonyms: None
SMILES: N#CC1=CC=C(OC(C)(C)C)C=C1I
Tpsa: 33.02
Logp: 3.34018
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:
C₁₁H₁₂INO
Molecular Weight:
301.12
Synonyms:
None
SMILES:
N#CC1=CC=C(OC(C)(C)C)C=C1I
Tpsa:
33.02
Logp:
3.34018
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1