(E) -Dec-2-enedioic acid

CAT: 0127-OR1047359-03Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR1047359-03Size:1 g

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CAS Number

37443-67-7

MDL Number

MFCD27969294

Purity

95%

Smiles

O=C(O)/C=C/CCCCCCC(O)=O

Chemical Information

(E)-2-Decenedioic acid

2E-decenedioic acid is a medium-chain fatty acid.

CAS Number	37443-67-7
PubChem CID	6442613
IUPAC Name	(E)-dec-2-enedioic acid
Molecular Formula	C10H16O4
Molecular Weight	200.23
XLogP	2
Topological Polar Surface Area	74.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	14
Formal Charge	0
Complexity	208

SMILES

C(CCCC(=O)O)CC/C=C/C(=O)O

InChI

InChI=1S/C10H16O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h5,7H,1-4,6,8H2,(H,11,12)(H,13,14)/b7-5+

InChIKey

XUNMWLWTZWWEIE-FNORWQNLSA-N

Chemical Structure

2D Structure

CAS: 37443-67-7

CID: 6442613

Formula: C10H16O4

MW: 200.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	200.23
XLogP3	2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	200.10485899
Monoisotopic Mass	200.10485899
Topological Polar Surface Area	74.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	208
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1102039-01	(E) -Hex-2-enedioic acid
OR1040644-01	(E) -dodec-6-enedioic acid
OR1026767-01	(E) -Dec-2-Enoic Acid
OR1007947-01	(2E) -Dimethylbut-2-Enedioic Acid
PC1002978-01	(2Z) -2-Fluorobut-2-enedioic acid
BUP01491-01	(E) -dec-3-enoic acid
OR1025828-01	Octadec-9-Enedioic Acid
OR21992	2-[ (4-Hydroxyphenyl) thio]but-2-enedioic acid
BUP19588	Ethyl (E) -dec-2-enoate
OR1046355-01	(Z) -Oct-4-enedioic acid

Catalog	Name
GTR19271240-01	(2E) -dec-2-enedioic acid
JH286400	Dec-5-enedioic acid
EAA44068	Hex-2-enedioic acid
NAA07460-01	2-Ethylbut-2-enedioic acid
WAA78849-01	(2E) -Dimethylbut-2-enedioic acid
GTR19272121-01	(2Z) -2-octylpent-2-enedioic acid
GTR19272173-01	(2E) -2-decylpent-2-enedioic acid
AAA67218-01	(2Z) -2-Fluorobut-2-enedioic acid
FAA02968-01	(2Z) -2-Iodobut-2-enedioic acid
sc-337862	Hex-2-enedioic acid dimethyl ester