CS-1045389
Tert-butyl 3-nitro-1H-indole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 198135-71-6
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₄N₂O₄
Molecular Weight
262.26
Synonyms
None
SMILES
O=C(OC(C)(C)C)N1C=C(C=2C=CC=CC21)N(=O)=O
Tpsa
74.37
Logp
3.3327
H Acceptors
5
H Donors
0
Rotatable Bonds
1
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₄N₂O₄
Molecular Weight: 262.26
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1C=C(C=2C=CC=CC21)N(=O)=O
Tpsa: 74.37
Logp: 3.3327
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₄N₂O₄
Molecular Weight:
262.26
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1C=C(C=2C=CC=CC21)N(=O)=O
Tpsa:
74.37
Logp:
3.3327
H Acceptors:
5
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: C₇H₉N₃O₄
Molecular Weight: 199.16
Synonyms: None
SMILES: O=C1C=CN(CC(C(O)=O)N)C(N1)=O
Tpsa: 118.18
Logp: -2.0515
H Acceptors: 5
H Donors: 3
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:
C₇H₉N₃O₄
Molecular Weight:
199.16
Synonyms:
None
SMILES:
O=C1C=CN(CC(C(O)=O)N)C(N1)=O
Tpsa:
118.18
Logp:
-2.0515
H Acceptors:
5
H Donors:
3
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: C₁₆H₃₄O
Molecular Weight: 242.44
Synonyms: None
SMILES: OC(CCC)CCCCCCCCCCCC
Tpsa: 20.23
Logp: 5.4584
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₃₄O
Molecular Weight:
242.44
Synonyms:
None
SMILES:
OC(CCC)CCCCCCCCCCCC
Tpsa:
20.23
Logp:
5.4584
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
13
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₄F₃NO₂
Molecular Weight: 215.13
Synonyms: None
SMILES: O=N(=O)C1=CC=C(C#CC(F)(F)F)C=C1
Tpsa: 43.14
Logp: 2.5086
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₄F₃NO₂
Molecular Weight:
215.13
Synonyms:
None
SMILES:
O=N(=O)C1=CC=C(C#CC(F)(F)F)C=C1
Tpsa:
43.14
Logp:
2.5086
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1