CS-1000227
Trehalose Dihydrate Impurity 1
Manufacturer: ChemScene
CAS Number: 103130-74-1
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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
C₁₈H₃₂O₁₆
Molecular Weight
504.44
Synonyms
None
SMILES
O([C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Tpsa
268.68
Logp
-7.573
H Acceptors
16
H Donors
11
Rotatable Bonds
7
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: C₁₈H₃₂O₁₆
Molecular Weight: 504.44
Synonyms: None
SMILES: O([C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Tpsa: 268.68
Logp: -7.573
H Acceptors: 16
H Donors: 11
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₃₂O₁₆
Molecular Weight:
504.44
Synonyms:
None
SMILES:
O([C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Tpsa:
268.68
Logp:
-7.573
H Acceptors:
16
H Donors:
11
Rotatable Bonds:
7
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₂ClNO₂
Molecular Weight: 283.79
Synonyms: None
SMILES: C(N(CCCCl)C)[C@@H]1C=2C(C1)=CC(OC)=C(OC)C2
Tpsa: 21.7
Logp: 2.9042
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 7
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₂ClNO₂
Molecular Weight:
283.79
Synonyms:
None
SMILES:
C(N(CCCCl)C)[C@@H]1C=2C(C1)=CC(OC)=C(OC)C2
Tpsa:
21.7
Logp:
2.9042
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
7
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₆FN₃O₃
Molecular Weight: 305.30
Synonyms: None
SMILES: O=C(O)C1=CN(C2=CC(NCCN)=C(F)C=C2C1=O)C3CC3
Tpsa: 97.35
Logp: 1.5443
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₆FN₃O₃
Molecular Weight:
305.30
Synonyms:
None
SMILES:
O=C(O)C1=CN(C2=CC(NCCN)=C(F)C=C2C1=O)C3CC3
Tpsa:
97.35
Logp:
1.5443
H Acceptors:
5
H Donors:
3
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: C₃₂H₂₉BrN₂O
Molecular Weight: 537.49
Synonyms: None
SMILES: BrC=1C=CC2=NC(OC)=C(C=C2C1)C(C=3C=CC=CC3)C(=CCN(C)C)C4=CC=CC=5C=CC=CC54
Tpsa: 25.36
Logp: 7.9362
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₂₉BrN₂O
Molecular Weight:
537.49
Synonyms:
None
SMILES:
BrC=1C=CC2=NC(OC)=C(C=C2C1)C(C=3C=CC=CC3)C(=CCN(C)C)C4=CC=CC=5C=CC=CC54
Tpsa:
25.36
Logp:
7.9362
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
7