CS-1086735
1-(Tert-butyl) 3-methyl 5-aminoazepane-1,3-dicarboxylate
Manufacturer: ChemScene
CAS Number: 2940946-55-2
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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
C₁₃H₂₄N₂O₄
Molecular Weight
272.34
Synonyms
None
SMILES
O=C(OC(C)(C)C)N1CCC(N)CC(C(=O)OC)C1
Tpsa
81.86
Logp
1.1338
H Acceptors
5
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: C₁₃H₂₄N₂O₄
Molecular Weight: 272.34
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CCC(N)CC(C(=O)OC)C1
Tpsa: 81.86
Logp: 1.1338
H Acceptors: 5
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:
C₁₃H₂₄N₂O₄
Molecular Weight:
272.34
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CCC(N)CC(C(=O)OC)C1
Tpsa:
81.86
Logp:
1.1338
H Acceptors:
5
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: C₇H₇N₅O₂
Molecular Weight: 193.16
Synonyms: None
SMILES: O=C(O)C=1C(=NN2N=CN=C(N)C12)C
Tpsa: 106.4
Logp: -0.28688
H Acceptors: 6
H Donors: 2
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:
C₇H₇N₅O₂
Molecular Weight:
193.16
Synonyms:
None
SMILES:
O=C(O)C=1C(=NN2N=CN=C(N)C12)C
Tpsa:
106.4
Logp:
-0.28688
H Acceptors:
6
H Donors:
2
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: C₁₂H₁₁BrFIN₂O
Molecular Weight: 425.04
Synonyms: None
SMILES: FC1=CC2=NN(C=C2C(Br)=C1I)C3OCCCC3
Tpsa: 27.05
Logp: 4.2416
H Acceptors: 3
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:
C₁₂H₁₁BrFIN₂O
Molecular Weight:
425.04
Synonyms:
None
SMILES:
FC1=CC2=NN(C=C2C(Br)=C1I)C3OCCCC3
Tpsa:
27.05
Logp:
4.2416
H Acceptors:
3
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: C₁₀H₉BrO
Molecular Weight: 225.08
Synonyms: None
SMILES: BrC=1OC=2C=CC(=CC2C1C)C
Tpsa: 13.14
Logp: 3.81214
H Acceptors: 1
H Donors: 0
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:
C₁₀H₉BrO
Molecular Weight:
225.08
Synonyms:
None
SMILES:
BrC=1OC=2C=CC(=CC2C1C)C
Tpsa:
13.14
Logp:
3.81214
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0