CS-1002129
Butanedioic acid, 2-[(2S)-3-carboxy-2-[(2S)-3-carboxy-2-[(2S)-3-carboxy-2-hydroxy-1-oxopropoxy]-1-oxopropoxy]-1-oxopropoxy]-, (2S)-
Manufacturer: ChemScene
CAS Number: 1800467-70-2
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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
C₁₆H₁₈O₁₇
Molecular Weight
482.30
Synonyms
None
SMILES
[C@@H](OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)(C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O
Tpsa
285.63
Logp
-2.9339
H Acceptors
12
H Donors
6
Rotatable Bonds
15
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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: C₁₆H₁₈O₁₇
Molecular Weight: 482.30
Synonyms: None
SMILES: [C@@H](OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)(C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O
Tpsa: 285.63
Logp: -2.9339
H Acceptors: 12
H Donors: 6
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₈O₁₇
Molecular Weight:
482.30
Synonyms:
None
SMILES:
[C@@H](OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)(C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O
Tpsa:
285.63
Logp:
-2.9339
H Acceptors:
12
H Donors:
6
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₂O₂₁
Molecular Weight: 598.38
Synonyms: None
SMILES: [C@H](C(O[C@H](C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O)=O)(OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)CC(O)=O
Tpsa: 349.23
Logp: -3.5474
H Acceptors: 15
H Donors: 7
Rotatable Bonds: 19
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₂O₂₁
Molecular Weight:
598.38
Synonyms:
None
SMILES:
[C@H](C(O[C@H](C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O)=O)(OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)CC(O)=O
Tpsa:
349.23
Logp:
-3.5474
H Acceptors:
15
H Donors:
7
Rotatable Bonds:
19
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₆O₂₅
Molecular Weight: 714.45
Synonyms: None
SMILES: [C@@H](OC([C@@H](OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)CC(O)=O)=O)(C(O[C@H](C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O)=O)CC(O)=O
Tpsa: 412.83
Logp: -4.1609
H Acceptors: 18
H Donors: 8
Rotatable Bonds: 23
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₆O₂₅
Molecular Weight:
714.45
Synonyms:
None
SMILES:
[C@@H](OC([C@@H](OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)CC(O)=O)=O)(C(O[C@H](C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O)=O)CC(O)=O
Tpsa:
412.83
Logp:
-4.1609
H Acceptors:
18
H Donors:
8
Rotatable Bonds:
23
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₃₀O₂₉
Molecular Weight: 830.52
Synonyms: None
SMILES: [C@H](C(O[C@H](C(O[C@H](C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O)=O)CC(O)=O)=O)(OC([C@@H](OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)CC(O)=O)=O)CC(O)=O
Tpsa: 476.43
Logp: -4.7744
H Acceptors: 21
H Donors: 9
Rotatable Bonds: 27
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₀O₂₉
Molecular Weight:
830.52
Synonyms:
None
SMILES:
[C@H](C(O[C@H](C(O[C@H](C(O[C@@H](CC(O)=O)C(O)=O)=O)CC(O)=O)=O)CC(O)=O)=O)(OC([C@@H](OC([C@@H](OC([C@H](CC(O)=O)O)=O)CC(O)=O)=O)CC(O)=O)=O)CC(O)=O
Tpsa:
476.43
Logp:
-4.7744
H Acceptors:
21
H Donors:
9
Rotatable Bonds:
27