CS-0764651
5-(Aminomethyl)-3',6'-Dihydroxy-3H-spiro[isobenzofuran-1,9'-xanthen]-3-one hydrochloride
Manufacturer: ChemScene
CAS Number: 141749-41-9
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₁H₁₆ClNO₅
Molecular Weight
397.81
Synonyms
None
SMILES
Cl.NCC1=CC=C2C(=C1)C(=O)OC21C2=CC=C(O)C=C2OC2=CC(O)=CC=C12
Tpsa
102.01
Logp
3.5463
H Acceptors
6
H Donors
3
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₁₆ClNO₅
Molecular Weight: 397.81
Synonyms: None
SMILES: Cl.NCC1=CC=C2C(=C1)C(=O)OC21C2=CC=C(O)C=C2OC2=CC(O)=CC=C12
Tpsa: 102.01
Logp: 3.5463
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₁₆ClNO₅
Molecular Weight:
397.81
Synonyms:
None
SMILES:
Cl.NCC1=CC=C2C(=C1)C(=O)OC21C2=CC=C(O)C=C2OC2=CC(O)=CC=C12
Tpsa:
102.01
Logp:
3.5463
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₈N₂O₃
Molecular Weight: 262.30
Synonyms: None
SMILES: CCOC(=O)[C@H](N)CC1=CNC2=CC(OC)=CC=C12
Tpsa: 77.34
Logp: 1.6094
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₈N₂O₃
Molecular Weight:
262.30
Synonyms:
None
SMILES:
CCOC(=O)[C@H](N)CC1=CNC2=CC(OC)=CC=C12
Tpsa:
77.34
Logp:
1.6094
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₈N₂O₄
Molecular Weight: 218.25
Synonyms: None
SMILES: N[C@@H](CCCCC[C@H](N)C(O)=O)C(O)=O
Tpsa: 126.64
Logp: -0.2393
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 8
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₈N₂O₄
Molecular Weight:
218.25
Synonyms:
None
SMILES:
N[C@@H](CCCCC[C@H](N)C(O)=O)C(O)=O
Tpsa:
126.64
Logp:
-0.2393
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀O₃S
Molecular Weight: 198.24
Synonyms: None
SMILES: CSC1=CC=C(C(C(O)O)=O)C=C1
Tpsa: 57.53
Logp: 0.9019
H Acceptors: 4
H Donors: 2
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:
C₉H₁₀O₃S
Molecular Weight:
198.24
Synonyms:
None
SMILES:
CSC1=CC=C(C(C(O)O)=O)C=C1
Tpsa:
57.53
Logp:
0.9019
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3