AG00ICYY

787544-61-0 | Benzenepropanoic acid, b-amino-3-nitro-, (bR)-

AG00ICYY

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	787544-61-0
Catalog Number	AG00ICYY(AGN-PC-0UDQNE)
Chemical Name	Benzenepropanoic acid, b-amino-3-nitro-, (bR)-
IUPAC Name	(3R)-3-amino-3-(3-nitrophenyl)propanoic acid
InChI	InChI=1S/C9H10N2O4/c10-8(5-9(12)13)6-2-1-3-7(4-6)11(14)15/h1-4,8H,5,10H2,(H,12,13)/t8-/m1/s1
InChI Key	SJBFILRQMRECCK-MRVPVSSYSA-N
MDL Number	MFCD04113660
Molecular Formula	C9H10N2O4
Molecular Weight	210.1867
SMILES	O=C(O)C[C@@H](N)C1=CC=CC([N+]([O-])=O)=C1
Synonyms	787544-61-0, (r)-3-amino-3-(3-nitrophenyl)propionic acid, (r)-3-amino-3-(3-nitro-phenyl)-propionic acid, (r)-3-(3-nitrophenyl)-beta-alanine, (r)-beta-(3-nitrophenyl)alanine, (3R)-3-amino-3-(3-nitrophenyl)propanoic acid, (r)-3-amino-3-(3-nitrophenyl)propanoic acid, h-d-beta-phe(3-no2)-oh, h-phg(3-no2)-(c*ch2)oh, R-3-Amino-3-(3-nitro-phenyl)-propionic acid, AK-44766, PubChem14111, AC1LE5I4, SCHEMBL3310878, (R)- -(3-Nitrophenyl)alanine, CTK7I5277, KS-00000KQX, ZINC93281, DTXSID10351676, SJBFILRQMRECCK-MRVPVSSYSA-N, ACT10339, ANW-48024, CN-494, MFCD04113660, AS06768, 3-NITRO-L-BETA-HOMOPHENYLGLYCINE, AC-25404, AJ-10919, AN-27396, AS-38155, BC676892, BR-44766, AB0007482, AX8034952, ST2402639, TC-136769, FT-0630181, TL80073861, W8465, (R)-3-(3-Nitrophenyl)-3-aminopropanoic acid, (r)-3-amino-3-(3-nitrophenyl)-propionic acid, A13115, S-3465, (r)-3-amino-3-(3-nitro-phenyl)-propanoic acid, Benzenepropanoic acid, b-amino-3-nitro-, (bR)-, 544A610, I01-9283, C9H10N2O4, NSC40724, CID706688, ACN-026113, (S)-2-amino-3-(3-nitrophenyl)propanoic acid, Benzenepropanoic acid, |A-amino-3-nitro-, (|AR)-,

Complexity	251
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	210.064g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	210.189g/mol
Monoisotopic Mass	210.064g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number