CS-1000141
1,4,8,11-Tetrakis(1,1-dimethylethyl) 1,4,8,11-tetraazacyclotetradecane-1,4,8,11-tetracarboxylate
Manufacturer: ChemScene
CAS Number: 1007858-12-9
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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
C₃₀H₅₆N₄O₈
Molecular Weight
600.79
Synonyms
None
SMILES
O=C(OC(C)(C)C)N1CCN(C(=O)OC(C)(C)C)CCCN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)CCC1
Tpsa
118.16
Logp
5.7286
H Acceptors
8
H Donors
0
Rotatable Bonds
0
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₃₀H₅₆N₄O₈
Molecular Weight: 600.79
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CCN(C(=O)OC(C)(C)C)CCCN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)CCC1
Tpsa: 118.16
Logp: 5.7286
H Acceptors: 8
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:
C₃₀H₅₆N₄O₈
Molecular Weight:
600.79
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CCN(C(=O)OC(C)(C)C)CCCN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)CCC1
Tpsa:
118.16
Logp:
5.7286
H Acceptors:
8
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: C₂₆H₂₈N₆
Molecular Weight: 424.54
Synonyms: None
SMILES: C=1(NC(=NC1)[C@@H]2CCCN2)C3=CC=C(C=C3)C4=CC=C(C=C4)C=5NC(=NC5)[C@@H]6CCCN6
Tpsa: 81.42
Logp: 4.9828
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₂₈N₆
Molecular Weight:
424.54
Synonyms:
None
SMILES:
C=1(NC(=NC1)[C@@H]2CCCN2)C3=CC=C(C=C3)C4=CC=C(C=C4)C=5NC(=NC5)[C@@H]6CCCN6
Tpsa:
81.42
Logp:
4.9828
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₀Cl₂N₂O₂
Molecular Weight: 307.22
Synonyms: None
SMILES: Cl.O=C(OCCN(CC)CC)C1=CC=C(Cl)C(N)=C1
Tpsa: 55.56
Logp: 2.8426
H Acceptors: 4
H Donors: 1
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:
C₁₃H₂₀Cl₂N₂O₂
Molecular Weight:
307.22
Synonyms:
None
SMILES:
Cl.O=C(OCCN(CC)CC)C1=CC=C(Cl)C(N)=C1
Tpsa:
55.56
Logp:
2.8426
H Acceptors:
4
H Donors:
1
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: C₆H₉N₅O
Molecular Weight: 167.17
Synonyms: None
SMILES: O=C1N=C(N)NC=2NCCNC12
Tpsa: 95.83
Logp: -0.8105
H Acceptors: 5
H Donors: 4
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:
C₆H₉N₅O
Molecular Weight:
167.17
Synonyms:
None
SMILES:
O=C1N=C(N)NC=2NCCNC12
Tpsa:
95.83
Logp:
-0.8105
H Acceptors:
5
H Donors:
4
Rotatable Bonds:
0