CS-1046670
2,2',2'',2''',2'''',2'''''-(1,4,7,10,13,16-Hexaazacyclooctadecane-1,4,7,10,13,16-hexayl)hexaacetic acid
Manufacturer: ChemScene
CAS Number: 96497-84-6
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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
C₂₄H₄₂N₆O₁₂
Molecular Weight
606.62
Synonyms
None
SMILES
O=C(O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1
Tpsa
243.24
Logp
-3.6804
H Acceptors
12
H Donors
6
Rotatable Bonds
12
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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: C₂₄H₄₂N₆O₁₂
Molecular Weight: 606.62
Synonyms: None
SMILES: O=C(O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1
Tpsa: 243.24
Logp: -3.6804
H Acceptors: 12
H Donors: 6
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₄₂N₆O₁₂
Molecular Weight:
606.62
Synonyms:
None
SMILES:
O=C(O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1
Tpsa:
243.24
Logp:
-3.6804
H Acceptors:
12
H Donors:
6
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅BrClFO
Molecular Weight: 251.48
Synonyms: None
SMILES: O=CC1=C(F)C(C)=CC(Cl)=C1Br
Tpsa: 17.07
Logp: 3.36252
H Acceptors: 1
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:
C₈H₅BrClFO
Molecular Weight:
251.48
Synonyms:
None
SMILES:
O=CC1=C(F)C(C)=CC(Cl)=C1Br
Tpsa:
17.07
Logp:
3.36252
H Acceptors:
1
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: C₁₈H₂₃NO₃
Molecular Weight: 301.38
Synonyms: None
SMILES: CCOC(C1=CC2=CC([C@H]3CC(C)(OCC3)C)=CC=C2N1)=O
Tpsa: 51.32
Logp: 4.0172
H Acceptors: 3
H Donors: 1
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:
C₁₈H₂₃NO₃
Molecular Weight:
301.38
Synonyms:
None
SMILES:
CCOC(C1=CC2=CC([C@H]3CC(C)(OCC3)C)=CC=C2N1)=O
Tpsa:
51.32
Logp:
4.0172
H Acceptors:
3
H Donors:
1
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: C₁₂H₂₅N₃O₄
Molecular Weight: 275.34
Synonyms: None
SMILES: O=C(N(CCN)NC(OC(C)(C)C)=O)OC(C)(C)C
Tpsa: 93.89
Logp: 1.6219
H Acceptors: 5
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:
C₁₂H₂₅N₃O₄
Molecular Weight:
275.34
Synonyms:
None
SMILES:
O=C(N(CCN)NC(OC(C)(C)C)=O)OC(C)(C)C
Tpsa:
93.89
Logp:
1.6219
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2