CS-1078951
1-(4-(But-3-yn-2-yl)-1,4-diazepan-1-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 2913419-71-1
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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
C₁₁H₁₈N₂O
Molecular Weight
194.27
Synonyms
None
SMILES
O=C(N1CCN(CCC1)C(C#C)C)C
Tpsa
23.55
Logp
0.5623
H Acceptors
2
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: C₁₁H₁₈N₂O
Molecular Weight: 194.27
Synonyms: None
SMILES: O=C(N1CCN(CCC1)C(C#C)C)C
Tpsa: 23.55
Logp: 0.5623
H Acceptors: 2
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:
C₁₁H₁₈N₂O
Molecular Weight:
194.27
Synonyms:
None
SMILES:
O=C(N1CCN(CCC1)C(C#C)C)C
Tpsa:
23.55
Logp:
0.5623
H Acceptors:
2
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: C₁₂H₁₇F₂NO₃
Molecular Weight: 261.27
Synonyms: None
SMILES: O=C(N1CC2CCCCC(C(=O)O)(C1)C2(F)F)C
Tpsa: 57.61
Logp: 1.745
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:
C₁₂H₁₇F₂NO₃
Molecular Weight:
261.27
Synonyms:
None
SMILES:
O=C(N1CC2CCCCC(C(=O)O)(C1)C2(F)F)C
Tpsa:
57.61
Logp:
1.745
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: C₁₁H₂₁NO₃S
Molecular Weight: 247.35
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CCSCC(CO)C1
Tpsa: 49.77
Logp: 1.5788
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:
C₁₁H₂₁NO₃S
Molecular Weight:
247.35
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CCSCC(CO)C1
Tpsa:
49.77
Logp:
1.5788
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: C₁₃H₁₅N₃O₄
Molecular Weight: 277.28
Synonyms: None
SMILES: O=C(O)C1=C(C=CC=2C=NNC21)NC(=O)OC(C)(C)C
Tpsa: 104.31
Logp: 2.6081
H Acceptors: 4
H Donors: 3
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:
C₁₃H₁₅N₃O₄
Molecular Weight:
277.28
Synonyms:
None
SMILES:
O=C(O)C1=C(C=CC=2C=NNC21)NC(=O)OC(C)(C)C
Tpsa:
104.31
Logp:
2.6081
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
2