CS-0312476
tert-Butyl 3-(1-methyl-1H-pyrazol-5-yl)pyrrolidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 1401304-49-1
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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
C₁₃H₂₁N₃O₂
Molecular Weight
251.32
Synonyms
1-Pyrrolidinecarboxylic acid, 3-(1-methyl-1H-pyrazol-5-yl)-, 1,1-dimethylethyl ester
SMILES
O=C(N1CC(C2=CC=NN2C)CC1)OC(C)(C)C
Tpsa
47.36
Logp
2.1445
H Acceptors
4
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₁N₃O₂
Molecular Weight: 251.32
Synonyms: 1-Pyrrolidinecarboxylic acid, 3-(1-methyl-1H-pyrazol-5-yl)-, 1,1-dimethylethyl ester
SMILES: O=C(N1CC(C2=CC=NN2C)CC1)OC(C)(C)C
Tpsa: 47.36
Logp: 2.1445
H Acceptors: 4
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:
C₁₃H₂₁N₃O₂
Molecular Weight:
251.32
Synonyms:
1-Pyrrolidinecarboxylic acid, 3-(1-methyl-1H-pyrazol-5-yl)-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CC(C2=CC=NN2C)CC1)OC(C)(C)C
Tpsa:
47.36
Logp:
2.1445
H Acceptors:
4
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: C₁₄H₂₄N₂O₃
Molecular Weight: 268.35
Synonyms: tert-butyl 3-(3-(diMethylaMino)acryloyl)pyrrolidine-1-carboxylate
SMILES: O=C(N1CC(C(/C=C/N(C)C)=O)CC1)OC(C)(C)C
Tpsa: 49.85
Logp: 1.8878
H Acceptors: 4
H Donors: 0
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:
C₁₄H₂₄N₂O₃
Molecular Weight:
268.35
Synonyms:
tert-butyl 3-(3-(diMethylaMino)acryloyl)pyrrolidine-1-carboxylate
SMILES:
O=C(N1CC(C(/C=C/N(C)C)=O)CC1)OC(C)(C)C
Tpsa:
49.85
Logp:
1.8878
H Acceptors:
4
H Donors:
0
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: C₁₄H₁₇N₃O₄
Molecular Weight: 291.30
Synonyms: None
SMILES: O=C(C1=CC=C2N=C(CNC(OC(C)(C)C)=O)NC2=C1)O
Tpsa: 104.31
Logp: 2.2858
H Acceptors: 4
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:
C₁₄H₁₇N₃O₄
Molecular Weight:
291.30
Synonyms:
None
SMILES:
O=C(C1=CC=C2N=C(CNC(OC(C)(C)C)=O)NC2=C1)O
Tpsa:
104.31
Logp:
2.2858
H Acceptors:
4
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: C₁₅H₁₉N₃O₄
Molecular Weight: 305.33
Synonyms: None
SMILES: O=C(C1=CC=C2N=C(CNC(OC(C)(C)C)=O)NC2=C1)OC
Tpsa: 93.31
Logp: 2.3742
H Acceptors: 5
H Donors: 2
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:
C₁₅H₁₉N₃O₄
Molecular Weight:
305.33
Synonyms:
None
SMILES:
O=C(C1=CC=C2N=C(CNC(OC(C)(C)C)=O)NC2=C1)OC
Tpsa:
93.31
Logp:
2.3742
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3