CS-0534135
tert-Butyl 6-amino-3-(bis(tert-butoxycarbonyl)amino)-1H-indazole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2768645-12-9
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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
C₂₂H₃₂N₄O₆
Molecular Weight
448.51
Synonyms
None
SMILES
O=C(N1N=C(N(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O)C2=C1C=C(N)C=C2)OC(C)(C)C
Tpsa
125.98
Logp
5.0783
H Acceptors
9
H Donors
1
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₃₂N₄O₆
Molecular Weight: 448.51
Synonyms: None
SMILES: O=C(N1N=C(N(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O)C2=C1C=C(N)C=C2)OC(C)(C)C
Tpsa: 125.98
Logp: 5.0783
H Acceptors: 9
H Donors: 1
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:
C₂₂H₃₂N₄O₆
Molecular Weight:
448.51
Synonyms:
None
SMILES:
O=C(N1N=C(N(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O)C2=C1C=C(N)C=C2)OC(C)(C)C
Tpsa:
125.98
Logp:
5.0783
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD09253770
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₃NO₃
Molecular Weight: 195.22
Synonyms: METHYL 4-((1R)-1-AMINO-2-HYDROXYETHYL)BENZOATE
SMILES: OC[C@H](C1=CC=C(C=C1)C(OC)=O)N
Tpsa: 72.55
Logp: 0.4653
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD09253770
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₃NO₃
Molecular Weight:
195.22
Synonyms:
METHYL 4-((1R)-1-AMINO-2-HYDROXYETHYL)BENZOATE
SMILES:
OC[C@H](C1=CC=C(C=C1)C(OC)=O)N
Tpsa:
72.55
Logp:
0.4653
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD11109464
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₉F₃N₂O₂
Molecular Weight: 258.20
Synonyms: 6-(trifluoromethyl)-1H-indazole-3-carboxylic acid ethyl ester
SMILES: O=C(C1=NNC2=C1C=CC(C(F)(F)F)=C2)OCC
Tpsa: 54.98
Logp: 2.7584
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD11109464
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₉F₃N₂O₂
Molecular Weight:
258.20
Synonyms:
6-(trifluoromethyl)-1H-indazole-3-carboxylic acid ethyl ester
SMILES:
O=C(C1=NNC2=C1C=CC(C(F)(F)F)=C2)OCC
Tpsa:
54.98
Logp:
2.7584
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: C₆H₃ClFNO₂
Molecular Weight: 175.54
Synonyms: 5-Chloro-2-fluoro-4-carboxypyridine
SMILES: O=C(C1=CC(F)=NC=C1Cl)O
Tpsa: 50.19
Logp: 1.5723
H Acceptors: 2
H Donors: 1
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:
C₆H₃ClFNO₂
Molecular Weight:
175.54
Synonyms:
5-Chloro-2-fluoro-4-carboxypyridine
SMILES:
O=C(C1=CC(F)=NC=C1Cl)O
Tpsa:
50.19
Logp:
1.5723
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1