DL-Aspartic Acid

CAT: 0127-OR480431-01Size: 500 gDry Ice: NoHazardous: No

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CAT#:0127-OR480431-01Size:500 g

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CAS Number

617-45-8

MDL Number

MFCD00063083

Purity

99%

Smiles

NC(CC(=O)O)C(=O)O

Chemical Information

(+-)-Aspartic Acid

Aspartic acid is an alpha-amino acid that consists of succinic acid bearing a single alpha-amino substituent. It has a role as a fundamental metabolite. It is a polar amino acid, an alpha-amino acid and a C4-dicarboxylic acid. It contains a carboxymethyl group. It is a conjugate acid of an aspartate and an aspartate(1-).

CAS Number	617-45-8
PubChem CID	424
IUPAC Name	2-aminobutanedioic acid
Molecular Formula	C4H7NO4
Molecular Weight	133.10
XLogP	-2.8
Topological Polar Surface Area	101
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	9
Formal Charge	0
Complexity	133

SMILES

C(C(C(=O)O)N)C(=O)O

InChI

InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)

InChIKey

CKLJMWTZIZZHCS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 617-45-8

CID: 424

Formula: C4H7NO4

MW: 133.10

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	133.10
XLogP3	-2.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	133.03750770
Monoisotopic Mass	133.03750770
Topological Polar Surface Area	101 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	133
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
HY-W015824-01	DL-Aspartic acid
037022-01	DL- Aspartic Acid
GPC4120-Y	DL-Aspartic Acid 99%
HY-W015824S3-01	DL-Aspartic acid-13C1
T78044-01	α-Methyl-DL-aspartic acid
TRC-D181930-500MG	Dansyl-DL-aspartic Acid
HY-W015824R-01	DL-Aspartic acid (Standard)
HY-W015824S-01	DL-Aspartic acid-13C

DL-Aspartic Acid

Chemical Information

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