Ac-Gly-BoroPro

CAT: 0607-BA5959-1Size: 1 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0607-BA5959-1Size:1 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

886992-99-0

Form

A solid

Molecular Formula

C8H15BN2O4

Molecular Weight

214.03

Shipping Conditions

Blue ice

Storage Conditions

-20°C, protect from light.

Chemical Information

Ac-Gly-BoroPro

CAS Number	886992-99-0
PubChem CID	102176419
IUPAC Name	[(2S)-1-(2-acetamidoacetyl)pyrrolidin-2-yl]boronic acid
Molecular Formula	C8H15BN2O4
Molecular Weight	214.03
Topological Polar Surface Area	89.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	15
Formal Charge	0
Complexity	259

SMILES

B([C@H]1CCCN1C(=O)CNC(=O)C)(O)O

InChI

InChI=1S/C8H15BN2O4/c1-6(12)10-5-8(13)11-4-2-3-7(11)9(14)15/h7,14-15H,2-5H2,1H3,(H,10,12)/t7-/m1/s1

InChIKey

UUOZISWTWURDGU-SSDOTTSWSA-N

Chemical Structure

2D Structure

CAS: 886992-99-0

CID: 102176419

Formula: C8H15BN2O4

MW: 214.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	214.03
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	214.1124871
Monoisotopic Mass	214.1124871
Topological Polar Surface Area	89.9 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	259
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes