CS-0458582
Tert-butyl 3-(1-amino-3-ethoxy-3-oxopropyl)pyrrolidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 887986-07-4
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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
C₁₄H₂₆N₂O₄
Molecular Weight
286.37
Synonyms
3-Pyrrolidinepropanoic acid, β-amino-1-[(1,1-dimethylethoxy)carbonyl]-, ethyl ester
SMILES
O=C(OCC)CC(N)C1CN(C(OC(C)(C)C)=O)CC1
Tpsa
81.86
Logp
1.5239
H Acceptors
5
H Donors
1
Rotatable Bonds
4
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: C₁₄H₂₆N₂O₄
Molecular Weight: 286.37
Synonyms: 3-Pyrrolidinepropanoic acid, β-amino-1-[(1,1-dimethylethoxy)carbonyl]-, ethyl ester
SMILES: O=C(OCC)CC(N)C1CN(C(OC(C)(C)C)=O)CC1
Tpsa: 81.86
Logp: 1.5239
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₆N₂O₄
Molecular Weight:
286.37
Synonyms:
3-Pyrrolidinepropanoic acid, β-amino-1-[(1,1-dimethylethoxy)carbonyl]-, ethyl ester
SMILES:
O=C(OCC)CC(N)C1CN(C(OC(C)(C)C)=O)CC1
Tpsa:
81.86
Logp:
1.5239
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₈ClFN₂O
Molecular Weight: 272.75
Synonyms: N-[(4-fluorophenyl)methyl]piperidine-2-carboxamide
SMILES: Cl.O=C(NCC1=CC=C(F)C=C1)C1CCCCN1
Tpsa: 41.13
Logp: 2.0058
H Acceptors: 2
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:
C₁₃H₁₈ClFN₂O
Molecular Weight:
272.75
Synonyms:
N-[(4-fluorophenyl)methyl]piperidine-2-carboxamide
SMILES:
Cl.O=C(NCC1=CC=C(F)C=C1)C1CCCCN1
Tpsa:
41.13
Logp:
2.0058
H Acceptors:
2
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: C₁₁H₂₃Br₂N
Molecular Weight: 329.12
Synonyms: Piperidine, 1-(6-bromohexyl)-, hydrobromide
SMILES: BrCCCCCCN1CCCCC1.[H]Br
Tpsa: 3.24
Logp: 4.0055
H Acceptors: 1
H Donors: 0
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:
C₁₁H₂₃Br₂N
Molecular Weight:
329.12
Synonyms:
Piperidine, 1-(6-bromohexyl)-, hydrobromide
SMILES:
BrCCCCCCN1CCCCC1.[H]Br
Tpsa:
3.24
Logp:
4.0055
H Acceptors:
1
H Donors:
0
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: C₈H₁₈Br₂N₂
Molecular Weight: 302.05
Synonyms: 3-(4-methylpiperazin-1-yl)-1-bromopropane dihydrobromide
SMILES: Br.CN1CCN(CCCBr)CC1
Tpsa: 6.48
Logp: 1.5967
H Acceptors: 2
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:
C₈H₁₈Br₂N₂
Molecular Weight:
302.05
Synonyms:
3-(4-methylpiperazin-1-yl)-1-bromopropane dihydrobromide
SMILES:
Br.CN1CCN(CCCBr)CC1
Tpsa:
6.48
Logp:
1.5967
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3