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Structure

Benzoicacid,4-[(octadecylamino)carbonyl]-,calcium salt(2:1)

CAS
85068-65-1
Catalog Number
ACM85068651
Category
Other Products
Molecular Weight
873.3112
Molecular Formula
C26H43NO3.1/2Ca

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Specification

Synonyms
EINECS 285-323-7, Calcium(2+) 4-((octadecylamino)carbonyl)benzoate, 85068-65-1
IUPAC Name
calcium 4-(octadecylcarbamoyl)benzoate
Canonical SMILES
CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)C(=O)[O-].CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)C(=O)[O-].[Ca+2]
InChI Key
WFIRISZSTMRUBK-UHFFFAOYSA-L
Density
g/cm³
EC Number
285-323-7
Exact Mass
872.59600
H-Bond Acceptor
6
H-Bond Donor
2
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