AG003JKF

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CAS Number	4368-06-3
Catalog Number	AG003JKF(AGN-PC-0JLFTG)
Chemical Name	3-Hydroxybutyronitrile
EC Number	224-457-2
IUPAC Name	3-hydroxybutanenitrile
InChI	InChI=1S/C4H7NO/c1-4(6)2-3-5/h4,6H,2H2,1H3
InChI Key	BYJAJQGCMSBKPB-UHFFFAOYSA-N
MDL Number	MFCD03427120
Molecular Formula	C4H7NO
Molecular Weight	85.1045
SMILES	CC(CC#N)O
Synonyms	3-Hydroxybutyronitrile, 3-hydroxybutanenitrile, 4368-06-3, beta-Hydroxybutyronitrile, Butanenitrile,3-hydroxy-, (3S)-, ACMC-20abbg, ACMC-20mrcu, 1-Cyanopropan-2-ol, beta-hydroxybutanenitrile, ACMC-1BYNJ, Butanenitrile,3-hydroxy-, AC1L31TN, 3-Hydroxybutyronitrile, 97%, AC1Q4S04, CTK4I7654, CHEBI:142961, BCP28827, EINECS 224-457-2, MFCD03427120, AKOS010136331, MCULE-7172428142, NE34884, 1,4-Bis(Chloromethyl)Tetramethyldisiloxane, TC-169570, EN300-76665, I14-49947, Z1259161730, (R)-3-Hydroxybutanenitrile, (S)-3-Hydroxybutanenitrile, (3S)-3-hydroxybutanenitrile, Butanenitrile,3-hydroxy-, (3R)-, AR-1F3693, CID107273, 123689-95-2, 125103-95-9, 4549-02-4,

Complexity	70.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	85.053g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	85.106g/mol
Monoisotopic Mass	85.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	44A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

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CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited