ChemicalBook--->CAS DataBase List--->1261578-13-5

1261578-13-5

1261578-13-5 Structure

1261578-13-5 Structure
IdentificationBack Directory
[Name]

(DL)-IsochroMan-3-carboxylic acid
[CAS]

1261578-13-5
[Synonyms]

ISOCHROMAN-3-CARBOXYLIC ACID
(DL)-IsochroMan-3-carboxylic acid
3,4-Dihydro-1h-2-benzopyran-3-carboxylic acid
1H-2-Benzopyran-3-carboxylic acid, 3,4-dihydro-
[EINECS(EC#)]

825-471-7
[Molecular Formula]

C10H10O3
[MDL Number]

MFCD18416383
[MOL File]

1261578-13-5.mol
[Molecular Weight]

178.18
Chemical PropertiesBack Directory
[Boiling point ]

371.0±42.0 °C(Predicted)
[density ]

1.276±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

3.50±0.20(Predicted)
[InChI]

InChI=1S/C10H10O3/c11-10(12)9-5-7-3-1-2-4-8(7)6-13-9/h1-4,9H,5-6H2,(H,11,12)
[InChIKey]

VXXPDVSKXQEYHP-UHFFFAOYSA-N
[SMILES]

C1(C(O)=O)OCC2=CC=CC=C2C1
Safety DataBack Directory
[HS Code ]

2932990090
Spectrum DetailBack Directory
[Spectrum Detail]

(DL)-IsochroMan-3-carboxylic acid(1261578-13-5)1HNMR
(DL)-IsochroMan-3-carboxylic acid(1261578-13-5)1HNMR
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