791039-94-6
BENZOIC ACID, 4-(1-AMINOETHYL)-3-NITRO-, (R)-
Name
BENZOIC ACID, 4-(1-AMINOETHYL)-3-NITRO-, (R)-
Formula
C9 H10 N2 O4
MolWeight
210.188
1Identification
【Name】
BENZOIC ACID, 4-(1-AMINOETHYL)-3-NITRO-, (R)-
【CAS】
【MDL】
MFCD11042404
【English Synonyms】
【Formula】
C9 H10 N2 O4
【MolWeight】
210.188
【Inchi】
InChI=1S/C9H10N2O4/c1-5(10)7-3-2-6(9(12)13)4-8(7)11(14)15/h2-5H,10H2,1H3,(H,12,13)/t5-/m1/s1
【InChIKey】
InChIKey=KSBVDNILPMPKSN-RXMQYKEDSA-N
【SMILES】
C[C@H](c1ccc(cc1[N+](=O)[O-])C(=O)O)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
BENZOIC ACID, 4-(1-AMINOETHYL)-3-NITRO-, (R)-.cml
Quick Release
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