AG00FB2U

73945-46-7 | 7-Chloro-L-tryptophan

AG00FB2U

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CAS Number	73945-46-7
Catalog Number	AG00FB2U(AGN-PC-0WANJN)
Chemical Name	7-Chloro-L-tryptophan
IUPAC Name	(2S)-2-amino-3-(7-chloro-1H-indol-3-yl)propanoic acid
InChI	InChI=1S/C11H11ClN2O2/c12-8-3-1-2-7-6(5-14-10(7)8)4-9(13)11(15)16/h1-3,5,9,14H,4,13H2,(H,15,16)/t9-/m0/s1
InChI Key	DMQFGLHRDFQKNR-VIFPVBQESA-N
MDL Number	MFCD09264322
Molecular Formula	C11H11ClN2O2
Molecular Weight	238.6702
SMILES	O=C(O)[C@@H](N)CC1=CNC2=C1C=CC=C2Cl
Synonyms	7-chlorotryptophan, 7-chloro-L-tryptophan, 7-Chlorotryptophan, 73945-46-7, (S)-2-amino-3-(7-chloro-1H-indol-3-yl)propanoic acid, L-Tryptophan, 7-chloro-, W-204244, (2S)-2-amino-3-(7-chloro-1H-indol-3-yl)propanoic acid, CTE, AK167512, Tryptophan,7-chloro-, AC1MIXTY, Tryptophan, 7-chloro-, DL-Tryptophan, 7-chloro-, SCHEMBL837413, CHEBI:47356, CTK0H7243, CS-D0040, MFCD09264322, ZINC13386795, AKOS025287309, DS-9523, AJ-63785, AN-44041, AX8269429, C19687, 945C467, 7-CHLORO-TRYPTOPHAN, C11H11ClN2O2, C11-H11-Cl-N2-O2, CID3081936, 153-97-9,

Complexity	275
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	238.051g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	238.671g/mol
Monoisotopic Mass	238.051g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	79.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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