CS-0371453
tert-Butyl 2-(acetamidomethyl)-4-aminopyrrolidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2352154-29-9
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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
C₁₂H₂₃N₃O₃
Molecular Weight
257.33
Synonyms
1-Pyrrolidinecarboxylic acid, 2-[(acetylamino)methyl]-4-amino-, 1,1-dimethylethyl ester
SMILES
O=C(N1C(CNC(C)=O)CC(N)C1)OC(C)(C)C
Tpsa
84.66
Logp
0.4592
H Acceptors
4
H Donors
2
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: C₁₂H₂₃N₃O₃
Molecular Weight: 257.33
Synonyms: 1-Pyrrolidinecarboxylic acid, 2-[(acetylamino)methyl]-4-amino-, 1,1-dimethylethyl ester
SMILES: O=C(N1C(CNC(C)=O)CC(N)C1)OC(C)(C)C
Tpsa: 84.66
Logp: 0.4592
H Acceptors: 4
H Donors: 2
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:
C₁₂H₂₃N₃O₃
Molecular Weight:
257.33
Synonyms:
1-Pyrrolidinecarboxylic acid, 2-[(acetylamino)methyl]-4-amino-, 1,1-dimethylethyl ester
SMILES:
O=C(N1C(CNC(C)=O)CC(N)C1)OC(C)(C)C
Tpsa:
84.66
Logp:
0.4592
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 95%
MDL No: MFCD00006634
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈O₄
Molecular Weight: 168.15
Synonyms: None
SMILES: O=C1C(C(C)=O)=C(O)C=C(C)O1
Tpsa: 67.51
Logp: 0.85642
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
MFCD00006634
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈O₄
Molecular Weight:
168.15
Synonyms:
None
SMILES:
O=C1C(C(C)=O)=C(O)C=C(C)O1
Tpsa:
67.51
Logp:
0.85642
H Acceptors:
4
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: C₈H₈N₄O₂
Molecular Weight: 192.17
Synonyms: 2,4-Diamino-1H-benzimidazole-6-carboxylic acid
SMILES: O=C(C1=CC(N)=C2C(N=C(N)N2)=C1)O
Tpsa: 118.02
Logp: 0.4255
H Acceptors: 4
H Donors: 4
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:
C₈H₈N₄O₂
Molecular Weight:
192.17
Synonyms:
2,4-Diamino-1H-benzimidazole-6-carboxylic acid
SMILES:
O=C(C1=CC(N)=C2C(N=C(N)N2)=C1)O
Tpsa:
118.02
Logp:
0.4255
H Acceptors:
4
H Donors:
4
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: C₇H₇BrN₄
Molecular Weight: 227.06
Synonyms: None
SMILES: NC1=NC2=CC(Br)=CC(N)=C2N1
Tpsa: 80.72
Logp: 1.4898
H Acceptors: 3
H Donors: 3
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:
C₇H₇BrN₄
Molecular Weight:
227.06
Synonyms:
None
SMILES:
NC1=NC2=CC(Br)=CC(N)=C2N1
Tpsa:
80.72
Logp:
1.4898
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
0