AG003T1B

5893-10-7 | N-Formyl-DL-alanine

AG003T1B

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CAS Number	5893-10-7
Catalog Number	AG003T1B(AGN-PC-0WBOTH)
Chemical Name	N-Formyl-DL-alanine
EC Number	227-574-7
IUPAC Name	2-formamidopropanoic acid
InChI	InChI=1S/C4H7NO3/c1-3(4(7)8)5-2-6/h2-3H,1H3,(H,5,6)(H,7,8)
InChI Key	SRBATDDRZARFDZ-UHFFFAOYSA-N
MDL Number	MFCD00063285
Molecular Formula	C4H7NO3
Molecular Weight	117.1033
NSC Number	6749
SMILES	CC(C(O)=O)NC=O
Synonyms	N-Formyl-DL-alanine, 2-formamidopropanoic acid, 5893-10-7, N-Formylalanine, 2-(formylamino)propanoic acid, DL-Alanine, N-formyl-, N-Formylalanine #, N-formyl-d,l-alanine, ACMC-1ALJU, AC1Q5SKY, ACMC-2098ev, 2-Formylaminopropanoic acid, AC1L2YJ1, 2-Formylamino-propionic acid, SCHEMBL697886, CTK7I1528, NSC6749, SRBATDDRZARFDZ-UHFFFAOYSA-N, ALBB-004064, KS-000017CC, NSC-6749, 6246AE, ANW-14007, MFCD00063285, STK502891, 4-Chloro-5-nitrophenyl methyl sulfone, AKOS001024047, AKOS016342109, MCULE-7277951464, NCGC00339440-01, TR-057985, BB 0240768, F0107, R1904, AB01332328-02, I04-0502, I04-0533, Z56757230, N-Formyl-L-alanine, (S)-2-Formamidopropanoic acid, C4H7NO3, (2S)-2-formamidopropanoic acid, Alanine, N-formyl- (7CI,9CI), CID79996, AR-1K7043, 10512-86-4, 5341-76-4,

Complexity	102
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	117.043g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	117.104g/mol
Monoisotopic Mass	117.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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